Vitas-M small molecule compound
2-[(3,4-dimethylphenyl)carbamoyl]-3-nitrobenzoic acid
Catalog ID
STK268025
SMILES OC(=O)c1cccc(c1C(=O)Nc1ccc(c(c1)C)C)[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 C16H14N2O5 MW 314.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N2O5/c1-9-6-7-11(8-10(9)2)17-15(19)14-12(16(20)21)4-3-5-13(14)18(22)23/h3-8H,1-2H3,(H,17,19)(H,20,21)InChIKey
PFRRDZIYRQNJLV-UHFFFAOYSA-NSynonyms
351998-00-02((34DIMETHYLANILINO)CARBONYL)3NITROBENZOICACID
2((34dimethylphenyl)carbamoyl)3nitrobenzoicacid
2(N(34DIMETHYLPHENYL)CARBAMOYL)3NITROBENZOICACID
351998000
CC1=C(C=C(C=C1)NC(=O)C2=C(C=CC=C2(N+)(=O)(O))C(=O)O)C
InChI=1SC16H14N2O5c196711(810(9)2)1715(19)1412(16(20)21)43513(14)18(22)23h38H12H3(H1719)(H2021)
MFCD01046557
OC(=O)c1cccc(c1C(=O)Nc1ccc(c(c1)C)C)(N+)(=O)(O)
ZINC000000482146
ZINC482146
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