Vitas-M small molecule compound
{3-hydroxy-4-[(4-methylphenyl)carbonyl]-5-(3-nitrophenyl)-2-oxo-2,5-dihydro-1H-pyrrol-1-yl}acetic acid
Catalog ID
STL328447
SMILES OC(=O)CN1C(=O)C(=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)c1ccc(cc1)C)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 C20H16N2O7 MW 396.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N2O7/c1-11-5-7-12(8-6-11)18(25)16-17(13-3-2-4-14(9-13)22(28)29)21(10-15(23)24)20(27)19(16)26/h2-9,17,26H,10H2,1H3,(H,23,24)InChIKey
MXMYOQKMODGLPP-UHFFFAOYSA-NSynonyms
(3hydroxy4((4methylphenyl)carbonyl)5(3nitrophenyl)2oxo25dihydro1Hpyrrol1yl)aceticacid
2(3hydroxy4(4methylbenzoyl)5(3nitrophenyl)2oxo25dihydro1Hpyrrol1yl)aceticacid
MFCD01032041
OC(=O)CN1C(=O)C(=C(C1c1cccc(c1)(N+)(=O)(O))C(=O)c1ccc(cc1)C)O
ZINC000019939414
ZINC000019939416
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