Vitas-M small molecule compound
(2Z)-4-(4-nitrophenyl)-4-oxo-2-(phenylamino)but-2-enoic acid
Catalog ID
STL447527
SMILES O=C(c1ccc(cc1)[N+](=O)[O-])/C=C(/C(=O)O)\Nc1ccccc1
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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 C16H12N2O5 MW 312.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12N2O5/c19-15(11-6-8-13(9-7-11)18(22)23)10-14(16(20)21)17-12-4-2-1-3-5-12/h1-10,17H,(H,20,21)/b14-10-InChIKey
GWEQEBHRKPKIOK-UVTDQMKNSA-NSynonyms
(2Z)2ANILINO4(4NITROPHENYL)4OXOBUT2ENOICACID
(2Z)4(4nitrophenyl)4oxo2(phenylamino)but2enoicacid
(Z)2ANILINO4(4NITROPHENYL)4OXOBUT2ENOICACID
C1=CC=C(C=C1)NC(=CC(=O)C2=CC=C(C=C2)(N+)(=O)(O))C(=O)O
InChI=1SC16H12N2O5c1915(116813(9711)18(22)23)1014(16(20)21)17124213512h11017H(H2021)b1410
MFCD06245047
O=C(c1ccc(cc1)(N+)(=O)(O))C=C(C(=O)O)Nc1ccccc1
ZINC000005243611
ZINC5243611
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