6,6-dimethyl-2-phenyl-3-(2,4,4-trimethylpentyl)-1,5,7,7a-tetrahydroindazol-4-one

Systemtic Name: 6,6-dimethyl-2-phenyl-3-(2,4,4-trimethylpentyl)-1,5,7,7a-tetrahydroindazol-4-one Openeye Name: 6,6-dimethyl-2-phenyl-3-(2,4,4-trimethylpentyl)-1,5,7,7a-tetrahydroindazol-4-one CAS Name: 6,6-dimethyl-2-phenyl-3-(2,4,4-trimethylpentyl)-1,5,7,7a-tetrahydroindazol-4-one IUPAC Name: 6,6-dimethyl-2-phenyl-3-(2,4,4-trimethylpentyl)-1,5,7,7a-tetrahydroindazol-4-one Traditional Name: 6,6-dimethyl-2-phenyl-3-(2,4,4-trimethylpentyl)-1,5,7,7a-tetrahydroindazol-4-one Formula: C23H34N2O MolecularWeight: 354.52886

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=C2C(CC(CC2=O)(C)C)NN1C3=CC=CC=C3)CC(C)(C)C

Isomeric SMILES

CC(CC1=C2C(CC(CC2=O)(C)C)NN1C3=CC=CC=C3)CC(C)(C)C

InChI

InChI=1S/C23H34N2O/c1-16(13-22(2,3)4)12-19-21-18(14-23(5,6)15-20(21)26)24-25(19)17-10-8-7-9-11-17/h7-11,16,18,24H,12-15H2,1-6H3