(Z)-4-(2,5-dimethylphenyl)-2-oxidanylidene-3-quinolin-2-yl-but-3-enoate

Systemtic Name: (Z)-4-(2,5-dimethylphenyl)-2-oxidanylidene-3-quinolin-2-yl-but-3-enoate Openeye Name: (Z)-4-(2,5-dimethylphenyl)-2-oxo-3-(2-quinolyl)but-3-enoate CAS Name: (Z)-4-(2,5-dimethylphenyl)-2-oxo-3-(2-quinolinyl)-3-butenoate IUPAC Name: (Z)-4-(2,5-dimethylphenyl)-2-oxo-3-quinolin-2-ylbut-3-enoate Traditional Name: (Z)-4-(2,5-dimethylphenyl)-2-keto-3-(2-quinolyl)but-3-enoate Formula: C21H16NO3- MolecularWeight: 330.35664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C=C(C2=NC3=CC=CC=C3C=C2)C(=O)C(=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)/C=C(/C2=NC3=CC=CC=C3C=C2)\C(=O)C(=O)[O-]

InChI

InChI=1S/C21H17NO3/c1-13-7-8-14(2)16(11-13)12-17(20(23)21(24)25)19-10-9-15-5-3-4-6-18(15)22-19/h3-12H,1-2H3,(H,24,25)/p-1/b17-12-