4-(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-3-[3-(4-methylphenyl)propyl]-1H-pyrazol-5-one

Systemtic Name: 4-(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-3-[3-(4-methylphenyl)propyl]-1H-pyrazol-5-one Openeye Name: 4-(3,5-ditert-butyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)-3-[3-(p-tolyl)propyl]-1H-pyrazol-5-one CAS Name: 4-(3,5-ditert-butyl-4-oxo-1-cyclohexa-2,5-dienylidene)-3-[3-(4-methylphenyl)propyl]-1H-pyrazol-5-one IUPAC Name: 4-(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)-3-[3-(4-methylphenyl)propyl]-1H-pyrazol-5-one Traditional Name: 4-(3,5-ditert-butyl-4-keto-cyclohexa-2,5-dien-1-ylidene)-5-[3-(p-tolyl)propyl]-2-pyrazolin-3-one Formula: C27H34N2O2 MolecularWeight: 418.57106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCCC2=NNC(=O)C2=C3C=C(C(=O)C(=C3)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CCCC2=NNC(=O)C2=C3C=C(C(=O)C(=C3)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C27H34N2O2/c1-17-11-13-18(14-12-17)9-8-10-22-23(25(31)29-28-22)19-15-20(26(2,3)4)24(30)21(16-19)27(5,6)7/h11-16H,8-10H2,1-7H3,(H,29,31)