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

Systemtic Name: 4-[[(4-chloranyl-3-nitro-phenyl)carbonylamino]methyl]benzoic acid Openeye Name: 4-[[(4-chloro-3-nitro-benzoyl)amino]methyl]benzoic acid CAS Name: 4-[[[(4-chloro-3-nitrophenyl)-oxomethyl]amino]methyl]benzoic acid IUPAC Name: 4-[[(4-chloro-3-nitrobenzoyl)amino]methyl]benzoic acid Traditional Name: 4-[[(4-chloro-3-nitro-benzoyl)amino]methyl]benzoic acid Formula: C15H11ClN2O5 MolecularWeight: 334.71124

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C15H11ClN2O5/c16-12-6-5-11(7-13(12)18(22)23)14(19)17-8-9-1-3-10(4-2-9)15(20)21/h1-7H,8H2,(H,17,19)(H,20,21)