4-[[(4-nitrophenyl)amino]methyl]benzoic acid

Systemtic Name: 4-[[(4-nitrophenyl)amino]methyl]benzoic acid Openeye Name: 4-[(4-nitroanilino)methyl]benzoic acid CAS Name: 4-[(4-nitroanilino)methyl]benzoic acid IUPAC Name: 4-[(4-nitroanilino)methyl]benzoic acid Traditional Name: 4-[(4-nitroanilino)methyl]benzoic acid Formula: C14H12N2O4 MolecularWeight: 272.25608

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CNC2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

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