3-[[(E)-3-(2-nitrophenyl)prop-2-enoyl]amino]benzoic acid

Systemtic Name: 3-[[(E)-3-(2-nitrophenyl)prop-2-enoyl]amino]benzoic acid Openeye Name: 3-[[(E)-3-(2-nitrophenyl)prop-2-enoyl]amino]benzoic acid CAS Name: 3-[[(E)-3-(2-nitrophenyl)-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 3-[[(E)-3-(2-nitrophenyl)prop-2-enoyl]amino]benzoic acid Traditional Name: 3-[[(E)-3-(2-nitrophenyl)acryloyl]amino]benzoic acid Formula: C16H12N2O5 MolecularWeight: 312.27688

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=CC(=O)NC2=CC=CC(=C2)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)/C=C/C(=O)NC2=CC=CC(=C2)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C16H12N2O5/c19-15(17-13-6-3-5-12(10-13)16(20)21)9-8-11-4-1-2-7-14(11)18(22)23/h1-10H,(H,17,19)(H,20,21)/b9-8+