4-[[(2-chloranyl-4-nitro-phenyl)carbonylamino]methyl]benzoic acid

Systemtic Name: 4-[[(2-chloranyl-4-nitro-phenyl)carbonylamino]methyl]benzoic acid Openeye Name: 4-[[(2-chloro-4-nitro-benzoyl)amino]methyl]benzoic acid CAS Name: 4-[[[(2-chloro-4-nitrophenyl)-oxomethyl]amino]methyl]benzoic acid IUPAC Name: 4-[[(2-chloro-4-nitrobenzoyl)amino]methyl]benzoic acid Traditional Name: 4-[[(2-chloro-4-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=C(C=C(C=C2)[N+](=O)[O-])Cl)C(=O)O

Isomeric SMILES

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

InChI

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