Vitas-M small molecule compound

2-(3-nitrophenyl)-2-oxoethyl 3-(1,3-dioxo-5-phenyloctahydro-2H-4,7-methanoisoindol-2-yl)benzoate

Catalog ID
STK290497
SMILES O=C(c1cccc(c1)N1C(=O)C2C(C1=O)C1CC2C(C1)c1ccccc1)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 C30H24N2O7 MW 524.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H24N2O7/c33-25(18-8-4-11-22(12-18)32(37)38)16-39-30(36)19-9-5-10-21(13-19)31-28(34)26-20-14-23(17-6-2-1-3-7-17)24(15-20)27(26)29(31)35/h1-13,20,23-24,26-27H,14-16H2
InChIKey
PGORHJJBYYEFID-UHFFFAOYSA-N
Synonyms

2(3nitrophenyl)2oxoethyl3(13dioxo5phenyloctahydro2H47methanoisoindol2yl)benzoate
C1C2CC(C1C3C2C(=O)N(C3=O)C4=CC=CC(=C4)C(=O)OCC(=O)C5=CC(=CC=C5)(N+)(=O)(O))C6=CC=CC=C6
InChI=1SC30H24N2O7c3325(18841122(1218)32(37)38)163930(36)19951021(1319)3128(34)26201423(176213717)24(1520)27(26)29(31)35h1132023242627H1416H2
MFCD04041757
O=C(c1cccc(c1)N1C(=O)C2C(C1=O)C1CC2C(C1)c1ccccc1)OCC(=O)c1cccc(c1)(N+)(=O)(O)
ZINC000102097592
ZINC000239174095

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Available files

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