3-[(2-nitrophenyl)methylamino]benzoic acid

Systemtic Name: 3-[(2-nitrophenyl)methylamino]benzoic acid Openeye Name: 3-[(2-nitrophenyl)methylamino]benzoic acid CAS Name: 3-[(2-nitrophenyl)methylamino]benzoic acid IUPAC Name: 3-[(2-nitrophenyl)methylamino]benzoic acid Traditional Name: 3-[(2-nitrobenzyl)amino]benzoic acid Formula: C14H12N2O4 MolecularWeight: 272.25608

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC2=CC=CC(=C2)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)CNC2=CC=CC(=C2)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C14H12N2O4/c17-14(18)10-5-3-6-12(8-10)15-9-11-4-1-2-7-13(11)16(19)20/h1-8,15H,9H2,(H,17,18)