Vitas-M small molecule compound

2-(3-nitrophenyl)-2-oxoethyl 2-[4-(4-tert-butylphenoxy)phenyl]-1,3-dioxo-2,3-dihydro-1H-isoindole-5-carboxylate

Catalog ID
STK269666
SMILES O=C1N(c2ccc(cc2)Oc2ccc(cc2)C(C)(C)C)C(=O)c2c1cc(cc2)C(=O)OCC(=O)c1cccc(c1)[N+](=O)[O-]

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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 C33H26N2O8 MW 578.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H26N2O8/c1-33(2,3)22-8-12-25(13-9-22)43-26-14-10-23(11-15-26)34-30(37)27-16-7-21(18-28(27)31(34)38)32(39)42-19-29(36)20-5-4-6-24(17-20)35(40)41/h4-18H,19H2,1-3H3
InChIKey
ZOZVLHSQILZOKH-UHFFFAOYSA-N
Synonyms

(2(3NITROPHENYL)2OXOETHYL)2(4(4TERTBUTYLPHENOXY)PHENYL)13DIOXOISOINDOLE5CARBOXYLATE
2(3nitrophenyl)2oxoethyl2(4(4tertbutylphenoxy)phenyl)13dioxo23dihydro1Hisoindole5carboxylate
CC(C)(C)C1=CC=C(C=C1)OC2=CC=C(C=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)OCC(=O)C5=CC(=CC=C5)(N+)(=O)(O)
InChI=1SC33H26N2O8c133(23)2281225(13922)4326141023(111526)3430(37)2716721(1828(27)31(34)38)32(39)421929(36)2054624(1720)35(40)41h418H19H213H3
MFCD02822492
O=C1N(c2ccc(cc2)Oc2ccc(cc2)C(C)(C)C)C(=O)c2c1cc(cc2)C(=O)OCC(=O)c1cccc(c1)(N+)(=O)(O)
ZINC000102078857
ZINC102078857

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Available files

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