2-methoxy-5-[[(3-nitrophenyl)carbonylamino]methyl]benzoic acid

Systemtic Name: 2-methoxy-5-[[(3-nitrophenyl)carbonylamino]methyl]benzoic acid Openeye Name: 2-methoxy-5-[[(3-nitrobenzoyl)amino]methyl]benzoic acid CAS Name: 2-methoxy-5-[[[(3-nitrophenyl)-oxomethyl]amino]methyl]benzoic acid IUPAC Name: 2-methoxy-5-[[(3-nitrobenzoyl)amino]methyl]benzoic acid Traditional Name: 2-methoxy-5-[[(3-nitrobenzoyl)amino]methyl]benzoic acid Formula: C16H14N2O6 MolecularWeight: 330.29216

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C16H14N2O6/c1-24-14-6-5-10(7-13(14)16(20)21)9-17-15(19)11-3-2-4-12(8-11)18(22)23/h2-8H,9H2,1H3,(H,17,19)(H,20,21)