4-[(1Z,3E)-2,4-dicyano-1-(2-methyl-1H-indol-3-yl)penta-1,3-dien-3-yl]benzoic acid

Systemtic Name: 4-[(1Z,3E)-2,4-dicyano-1-(2-methyl-1H-indol-3-yl)penta-1,3-dien-3-yl]benzoic acid Openeye Name: 4-[(E)-2-cyano-1-[(Z)-1-cyano-2-(2-methyl-1H-indol-3-yl)vinyl]prop-1-enyl]benzoic acid CAS Name: 4-[(1Z,3E)-2,4-dicyano-1-(2-methyl-1H-indol-3-yl)penta-1,3-dien-3-yl]benzoic acid IUPAC Name: 4-[(1Z,3E)-2,4-dicyano-1-(2-methyl-1H-indol-3-yl)penta-1,3-dien-3-yl]benzoic acid Traditional Name: 4-[(E)-2-cyano-1-[(Z)-1-cyano-2-(2-methyl-1H-indol-3-yl)vinyl]prop-1-enyl]benzoic acid Formula: C23H17N3O2 MolecularWeight: 367.39998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C=C(C#N)C(=C(C)C#N)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)/C=C(\C#N)/C(=C(\C)/C#N)/C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C23H17N3O2/c1-14(12-24)22(16-7-9-17(10-8-16)23(27)28)18(13-25)11-20-15(2)26-21-6-4-3-5-19(20)21/h3-11,26H,1-2H3,(H,27,28)/b18-11+,22-14+