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

Systemtic Name: 4-[[(2E,4Z)-4-bromanyl-2-cyano-5-phenyl-penta-2,4-dienoyl]amino]benzoic acid Openeye Name: 4-[[(2E,4Z)-4-bromo-2-cyano-5-phenyl-penta-2,4-dienoyl]amino]benzoic acid CAS Name: 4-[[(2E,4Z)-4-bromo-2-cyano-1-oxo-5-phenylpenta-2,4-dienyl]amino]benzoic acid IUPAC Name: 4-[[(2E,4Z)-4-bromo-2-cyano-5-phenylpenta-2,4-dienoyl]amino]benzoic acid Traditional Name: 4-[[(2E,4Z)-4-bromo-2-cyano-5-phenyl-penta-2,4-dienoyl]amino]benzoic acid Formula: C19H13BrN2O3 MolecularWeight: 397.22212

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=C(C=C(C#N)C(=O)NC2=CC=C(C=C2)C(=O)O)Br

Isomeric SMILES

C1=CC=C(C=C1)/C=C(/C=C(\C#N)/C(=O)NC2=CC=C(C=C2)C(=O)O)\Br

InChI

InChI=1S/C19H13BrN2O3/c20-16(10-13-4-2-1-3-5-13)11-15(12-21)18(23)22-17-8-6-14(7-9-17)19(24)25/h1-11H,(H,22,23)(H,24,25)/b15-11+,16-10-