[(2S,5R)-5-acetyloxy-4,4-diphenyl-heptan-2-yl]-dimethyl-azanium

Systemtic Name: [(2S,5R)-5-acetyloxy-4,4-diphenyl-heptan-2-yl]-dimethyl-azanium Openeye Name: [(1S,4R)-4-acetoxy-1-methyl-3,3-diphenyl-hexyl]-dimethyl-ammonium CAS Name: [(2S,5R)-5-acetyloxy-4,4-diphenylheptan-2-yl]-dimethylammonium IUPAC Name: [(2S,5R)-5-acetyloxy-4,4-diphenylheptan-2-yl]-dimethylazanium Traditional Name: [(1S,4R)-4-acetoxy-1-methyl-3,3-diphenyl-hexyl]-dimethyl-ammonium Formula: C23H32NO2+ MolecularWeight: 354.50568

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(CC(C)[NH+](C)C)(C1=CC=CC=C1)C2=CC=CC=C2)OC(=O)C

Isomeric SMILES

CC[C@H](C(C[C@H](C)[NH+](C)C)(C1=CC=CC=C1)C2=CC=CC=C2)OC(=O)C

InChI

InChI=1S/C23H31NO2/c1-6-22(26-19(3)25)23(17-18(2)24(4)5,20-13-9-7-10-14-20)21-15-11-8-12-16-21/h7-16,18,22H,6,17H2,1-5H3/p+1/t18-,22+/m0/s1