Vitas-M small molecule compound
3-(2-carboxyethyl)-2-[(E)-2-(phenylamino)ethenyl]-1,3-benzoxazol-3-ium
Catalog ID
STK326773
SMILES OC(=O)CC[n+]1c(/C=C/Nc2ccccc2)oc2c1cccc2
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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 C18H17N2O3 MW 309.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O3/c21-18(22)11-13-20-15-8-4-5-9-16(15)23-17(20)10-12-19-14-6-2-1-3-7-14/h1-10,12H,11,13H2,(H,21,22)/p+1InChIKey
GRMYUDFDCFVVJZ-UHFFFAOYSA-OSynonyms
3(2((E)2ANILINOETHENYL)13BENZOXAZOL3IUM3YL)PROPANOICACID
3(2(2ANILINOETHENYL)13BENZOXAZOL3IUM3YL)PROPANOICACID
3(2carboxyethyl)2((E)2(phenylamino)ethenyl)13benzoxazol3ium
3(2CARBOXYETHYL)2(2ANILINOETHENYL)BENZOXAZOLIUM
3(2CARBOXYETHYL)2(2PHENYLAMINOVINYL)BENZOOXAZOL3IUM
C1=CC=C(C=C1)NC=CC2=(N+)(C3=CC=CC=C3O2)CCC(=O)O
InChI=1SC18H16N2O3c2118(22)11132015845916(15)2317(20)101219146213714h11012H1113H2(H2122)p+1
MFCD00602731
OC(=O)CC(n+)1c(C=CNc2ccccc2)oc2c1cccc2
ZINC000263592344
ZINC000334157136
ZINC294894
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