(4E)-4-[5-methyl-2-(2-methylphenyl)-4-quinolin-2-yl-1H-pyrazol-3-ylidene]-3-oxidanyl-cyclohexa-2,5-dien-1-one

Systemtic Name: (4E)-4-[5-methyl-2-(2-methylphenyl)-4-quinolin-2-yl-1H-pyrazol-3-ylidene]-3-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: (4E)-3-hydroxy-4-[5-methyl-2-(o-tolyl)-4-(2-quinolyl)-1H-pyrazol-3-ylidene]cyclohexa-2,5-dien-1-one CAS Name: (4E)-3-hydroxy-4-[5-methyl-2-(2-methylphenyl)-4-(2-quinolinyl)-1H-pyrazol-3-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: (4E)-3-hydroxy-4-[5-methyl-2-(2-methylphenyl)-4-quinolin-2-yl-1H-pyrazol-3-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: (4E)-3-hydroxy-4-[5-methyl-2-(o-tolyl)-4-(2-quinolyl)-3-pyrazolin-3-ylidene]cyclohexa-2,5-dien-1-one Formula: C26H21N3O2 MolecularWeight: 407.46384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=C3C=CC(=O)C=C3O)C(=C(N2)C)C4=NC5=CC=CC=C5C=C4

Isomeric SMILES

CC1=CC=CC=C1N2/C(=C/3\C=CC(=O)C=C3O)/C(=C(N2)C)C4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C26H21N3O2/c1-16-7-3-6-10-23(16)29-26(20-13-12-19(30)15-24(20)31)25(17(2)28-29)22-14-11-18-8-4-5-9-21(18)27-22/h3-15,28,31H,1-2H3/b26-20+