1-(4-chlorophenyl)-6,6-dimethyl-3-[(4-methylphenyl)amino]-5,7-dihydroindazol-4-one

Systemtic Name: 1-(4-chlorophenyl)-6,6-dimethyl-3-[(4-methylphenyl)amino]-5,7-dihydroindazol-4-one Openeye Name: 1-(4-chlorophenyl)-6,6-dimethyl-3-(4-methylanilino)-5,7-dihydroindazol-4-one CAS Name: 1-(4-chlorophenyl)-6,6-dimethyl-3-(4-methylanilino)-5,7-dihydroindazol-4-one IUPAC Name: 1-(4-chlorophenyl)-6,6-dimethyl-3-(4-methylanilino)-5,7-dihydroindazol-4-one Traditional Name: 1-(4-chlorophenyl)-6,6-dimethyl-3-(p-toluidino)-5,7-dihydroindazol-4-one Formula: C22H22ClN3O MolecularWeight: 379.88258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NN(C3=C2C(=O)CC(C3)(C)C)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NN(C3=C2C(=O)CC(C3)(C)C)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H22ClN3O/c1-14-4-8-16(9-5-14)24-21-20-18(12-22(2,3)13-19(20)27)26(25-21)17-10-6-15(23)7-11-17/h4-11H,12-13H2,1-3H3,(H,24,25)