1-(4-iodophenyl)-6,6-dimethyl-3-(2,4,4-trimethylpentyl)-5,7-dihydroindazol-4-one

Systemtic Name: 1-(4-iodophenyl)-6,6-dimethyl-3-(2,4,4-trimethylpentyl)-5,7-dihydroindazol-4-one Openeye Name: 1-(4-iodophenyl)-6,6-dimethyl-3-(2,4,4-trimethylpentyl)-5,7-dihydroindazol-4-one CAS Name: 1-(4-iodophenyl)-6,6-dimethyl-3-(2,4,4-trimethylpentyl)-5,7-dihydroindazol-4-one IUPAC Name: 1-(4-iodophenyl)-6,6-dimethyl-3-(2,4,4-trimethylpentyl)-5,7-dihydroindazol-4-one Traditional Name: 1-(4-iodophenyl)-6,6-dimethyl-3-(2,4,4-trimethylpentyl)-5,7-dihydroindazol-4-one Formula: C23H31IN2O MolecularWeight: 478.40951

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=NN(C2=C1C(=O)CC(C2)(C)C)C3=CC=C(C=C3)I)CC(C)(C)C

Isomeric SMILES

CC(CC1=NN(C2=C1C(=O)CC(C2)(C)C)C3=CC=C(C=C3)I)CC(C)(C)C

InChI

InChI=1S/C23H31IN2O/c1-15(12-22(2,3)4)11-18-21-19(13-23(5,6)14-20(21)27)26(25-18)17-9-7-16(24)8-10-17/h7-10,15H,11-14H2,1-6H3