3-[(4-methyl-3-nitro-phenyl)carbamoylamino]benzoic acid

Systemtic Name: 3-[(4-methyl-3-nitro-phenyl)carbamoylamino]benzoic acid Openeye Name: 3-[(4-methyl-3-nitro-phenyl)carbamoylamino]benzoic acid CAS Name: 3-[[(4-methyl-3-nitroanilino)-oxomethyl]amino]benzoic acid IUPAC Name: 3-[(4-methyl-3-nitrophenyl)carbamoylamino]benzoic acid Traditional Name: 3-[(4-methyl-3-nitro-phenyl)carbamoylamino]benzoic acid Formula: C15H13N3O5 MolecularWeight: 315.28082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NC2=CC=CC(=C2)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NC2=CC=CC(=C2)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C15H13N3O5/c1-9-5-6-12(8-13(9)18(22)23)17-15(21)16-11-4-2-3-10(7-11)14(19)20/h2-8H,1H3,(H,19,20)(H2,16,17,21)