2-[[(2E,4E)-2-cyano-5-(2-nitrophenyl)penta-2,4-dienoyl]amino]benzoic acid

Systemtic Name: 2-[[(2E,4E)-2-cyano-5-(2-nitrophenyl)penta-2,4-dienoyl]amino]benzoic acid Openeye Name: 2-[[(2E,4E)-2-cyano-5-(2-nitrophenyl)penta-2,4-dienoyl]amino]benzoic acid CAS Name: 2-[[(2E,4E)-2-cyano-5-(2-nitrophenyl)-1-oxopenta-2,4-dienyl]amino]benzoic acid IUPAC Name: 2-[[(2E,4E)-2-cyano-5-(2-nitrophenyl)penta-2,4-dienoyl]amino]benzoic acid Traditional Name: 2-[[(2E,4E)-2-cyano-5-(2-nitrophenyl)penta-2,4-dienoyl]amino]benzoic acid Formula: C19H13N3O5 MolecularWeight: 363.32362

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=CC=C(C#N)C(=O)NC2=CC=CC=C2C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)/C=C/C=C(\C#N)/C(=O)NC2=CC=CC=C2C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C19H13N3O5/c20-12-14(8-5-7-13-6-1-4-11-17(13)22(26)27)18(23)21-16-10-3-2-9-15(16)19(24)25/h1-11H,(H,21,23)(H,24,25)/b7-5+,14-8+