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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C=CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

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

InChI

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