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

Systemtic Name: 4-[(4-bromanyl-3-nitro-phenyl)carbonylamino]-3-methyl-benzoic acid Openeye Name: 4-[(4-bromo-3-nitro-benzoyl)amino]-3-methyl-benzoic acid CAS Name: 4-[[(4-bromo-3-nitrophenyl)-oxomethyl]amino]-3-methylbenzoic acid IUPAC Name: 4-[(4-bromo-3-nitrobenzoyl)amino]-3-methylbenzoic acid Traditional Name: 4-[(4-bromo-3-nitro-benzoyl)amino]-3-methyl-benzoic acid Formula: C15H11BrN2O5 MolecularWeight: 379.16224

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H11BrN2O5/c1-8-6-10(15(20)21)3-5-12(8)17-14(19)9-2-4-11(16)13(7-9)18(22)23/h2-7H,1H3,(H,17,19)(H,20,21)