Vitas-M small molecule compound
2-(4-{[(4-nitrophenyl)carbonyl]oxy}phenyl)-2-oxoethyl thiophene-2-carboxylate
Catalog ID
STK258251
SMILES O=C(c1ccc(cc1)OC(=O)c1ccc(cc1)[N+](=O)[O-])COC(=O)c1cccs1
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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 C20H13NO7S MW 411.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13NO7S/c22-17(12-27-20(24)18-2-1-11-29-18)13-5-9-16(10-6-13)28-19(23)14-3-7-15(8-4-14)21(25)26/h1-11H,12H2InChIKey
JCSNJSHRLHKPAW-UHFFFAOYSA-NSynonyms
(2(4(4NITROBENZOYL)OXYPHENYL)2OXOETHYL)THIOPHENE2CARBOXYLATE
2(4(((4nitrophenyl)carbonyl)oxy)phenyl)2oxoethylthiophene2carboxylate
C1=CSC(=C1)C(=O)OCC(=O)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC20H13NO7Sc2217(122720(24)1821112918)135916(10613)2819(23)143715(8414)21(25)26h111H12H2
MFCD04074083
O=C(c1ccc(cc1)OC(=O)c1ccc(cc1)(N+)(=O)(O))COC(=O)c1cccs1
ZINC000006926697
ZINC06926697
ZINC6926697
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