4-[4-(2-methylpropyl)-2,5-diphenyl-1H-pyrazol-3-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[4-(2-methylpropyl)-2,5-diphenyl-1H-pyrazol-3-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-(4-isobutyl-2,5-diphenyl-1H-pyrazol-3-ylidene)cyclohexa-2,5-dien-1-one CAS Name: 4-[4-(2-methylpropyl)-2,5-diphenyl-1H-pyrazol-3-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[4-(2-methylpropyl)-2,5-diphenyl-1H-pyrazol-3-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-(4-isobutyl-2,5-diphenyl-3-pyrazolin-3-ylidene)cyclohexa-2,5-dien-1-one Formula: C25H24N2O MolecularWeight: 368.47086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(NN(C1=C2C=CC(=O)C=C2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)CC1=C(NN(C1=C2C=CC(=O)C=C2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H24N2O/c1-18(2)17-23-24(19-9-5-3-6-10-19)26-27(21-11-7-4-8-12-21)25(23)20-13-15-22(28)16-14-20/h3-16,18,26H,17H2,1-2H3