2-(4-chlorophenyl)-4-(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-5-methyl-pyrazol-3-one

Systemtic Name: 2-(4-chlorophenyl)-4-(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-5-methyl-pyrazol-3-one Openeye Name: 2-(4-chlorophenyl)-4-(3,5-ditert-butyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)-5-methyl-pyrazol-3-one CAS Name: 2-(4-chlorophenyl)-4-(3,5-ditert-butyl-4-oxo-1-cyclohexa-2,5-dienylidene)-5-methyl-3-pyrazolone IUPAC Name: 2-(4-chlorophenyl)-4-(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)-5-methylpyrazol-3-one Traditional Name: 2-(4-chlorophenyl)-4-(3,5-ditert-butyl-4-keto-cyclohexa-2,5-dien-1-ylidene)-5-methyl-2-pyrazolin-3-one Formula: C24H27ClN2O2 MolecularWeight: 410.93638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H27ClN2O2/c1-14-20(22(29)27(26-14)17-10-8-16(25)9-11-17)15-12-18(23(2,3)4)21(28)19(13-15)24(5,6)7/h8-13H,1-7H3