[(4S)-6,6-dimethyl-1-phenyl-5,7-dihydro-4H-indazol-4-yl]-[(3-ethanoylphenyl)methyl]azanium

Systemtic Name: [(4S)-6,6-dimethyl-1-phenyl-5,7-dihydro-4H-indazol-4-yl]-[(3-ethanoylphenyl)methyl]azanium Openeye Name: (3-acetylphenyl)methyl-[(4S)-6,6-dimethyl-1-phenyl-5,7-dihydro-4H-indazol-4-yl]ammonium CAS Name: (3-acetylphenyl)methyl-[(4S)-6,6-dimethyl-1-phenyl-5,7-dihydro-4H-indazol-4-yl]ammonium IUPAC Name: (3-acetylphenyl)methyl-[(4S)-6,6-dimethyl-1-phenyl-5,7-dihydro-4H-indazol-4-yl]azanium Traditional Name: (3-acetylbenzyl)-[(4S)-6,6-dimethyl-1-phenyl-5,7-dihydro-4H-indazol-4-yl]ammonium Formula: C24H28N3O+ MolecularWeight: 374.49862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)C[NH2+]C2CC(CC3=C2C=NN3C4=CC=CC=C4)(C)C

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)C[NH2+][C@H]2CC(CC3=C2C=NN3C4=CC=CC=C4)(C)C

InChI

InChI=1S/C24H27N3O/c1-17(28)19-9-7-8-18(12-19)15-25-22-13-24(2,3)14-23-21(22)16-26-27(23)20-10-5-4-6-11-20/h4-12,16,22,25H,13-15H2,1-3H3/p+1/t22-/m0/s1