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

Systemtic Name: 4-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]benzoic acid Openeye Name: 4-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]benzoic acid CAS Name: 4-[[(E)-3-(3-nitrophenyl)-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 4-[[(E)-3-(3-nitrophenyl)prop-2-enoyl]amino]benzoic acid Traditional Name: 4-[[(E)-3-(3-nitrophenyl)acryloyl]amino]benzoic acid Formula: C16H12N2O5 MolecularWeight: 312.27688

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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