6-(dimethylamino)-5-methyl-4,4-diphenyl-hexan-3-one; nitric acid

Systemtic Name: 6-(dimethylamino)-5-methyl-4,4-diphenyl-hexan-3-one; nitric acid Openeye Name: 6-(dimethylamino)-5-methyl-4,4-diphenyl-hexan-3-one; nitric acid CAS Name: 6-(dimethylamino)-5-methyl-4,4-diphenyl-3-hexanone; nitric acid IUPAC Name: 6-(dimethylamino)-5-methyl-4,4-diphenylhexan-3-one; nitric acid Traditional Name: 6-(dimethylamino)-5-methyl-4,4-diphenyl-hexan-3-one; nitric acid Formula: C21H28N2O4 MolecularWeight: 372.45802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)C(C)CN(C)C.[N+](=O)(O)[O-]

Isomeric SMILES

CCC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)C(C)CN(C)C.[N+](=O)(O)[O-]

InChI

InChI=1S/C21H27NO.HNO3/c1-5-20(23)21(17(2)16-22(3)4,18-12-8-6-9-13-18)19-14-10-7-11-15-19;2-1(3)4/h6-15,17H,5,16H2,1-4H3;(H,2,3,4)