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3-ethyl-2-{(1E)-2-[(Z)-(3-ethyl-5-phenyl-1,3-benzoxazol-2(3H)-ylidene)methyl]but-1-en-1-yl}-5-phenyl-1,3-benzoxazol-3-ium

Catalog ID
STK082550
SMILES CC/C(=C\c1oc2c([n+]1CC)cc(cc2)c1ccccc1)/C=c/1\oc2c(n1CC)cc(cc2)c1ccccc1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C35H33N2O2 MW 513.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H33N2O2/c1-4-25(21-34-36(5-2)30-23-28(17-19-32(30)38-34)26-13-9-7-10-14-26)22-35-37(6-3)31-24-29(18-20-33(31)39-35)27-15-11-8-12-16-27/h7-24H,4-6H2,1-3H3/q+1
InChIKey
GJDCORVLYUCREY-UHFFFAOYSA-N
Synonyms
17694-05-2
(2E)3ETHYL2((2E)2((3ETHYL5PHENYL13BENZOXAZOL3IUM2YL)METHYLIDENE)BUTYLIDENE)5PHENYL13BENZOXAZOLE
(2Z)3ETHYL2((2E)2((3ETHYL5PHENYL13BENZOXAZOL3IUM2YL)METHYLIDENE)BUTYLIDENE)5PHENYL13BENZOXAZOLE
17694052
2((E)3((Z)3ETHYL5PHENYLBENZOXAZOL2(3H)YLIDENE)2ETHYL1PROPENYL)3ETHYL5PHENYLBENZOXAZOLIUM
2(2(3ETHYL5PHENYL23DIHYDROBENZOXAZOLE2YLIDENEMETHYL)1BUTENYL)3ETHYL5PHENYLBENZOXAZOLE3IUM
3ETHYL2((1E)2((Z)(3ETHYL5PHENYL13BENZOXAZOL2(3H)YLIDENE)METHYL)BUT1EN1YL)5PHENYL13BENZOXAZOL3IUM
3ETHYL2(2((3ETHYL5PHENYL13BENZOXAZOL3IUM2YL)METHYLIDENE)BUTYLIDENE)5PHENYL13BENZOXAZOLE
3ETHYL2(2((3ETHYL5PHENYL2(3H)BENZOXAZOLYLIDENE)METHYL)1BUTENYL)5PHENYLBENZOXAZOLIUM
CCC(=CC1=(N+)(C2=C(O1)C=CC(=C2)C3=CC=CC=C3)CC)C=C4N(C5=C(O4)C=CC(=C5)C6=CC=CC=C6)CC
CCC(=Cc1oc2c((n+)1CC)cc(cc2)c1ccccc1)C=c1oc2c(n1CC)cc(cc2)c1ccccc1
InChI=1SC35H33N2O2c1425(213436(52)302328(171932(30)3834)261397101426)223537(63)312429(182033(31)3935)2715118121627h724H46H213H3q+1
MFCD00986494
STK082550
ZINC04825053
ZINC4825053

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Available files

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