1-(azepan-1-yl)-3-(2-methylphenyl)propan-2-amine dihydrochloride

Systemtic Name: 1-(azepan-1-yl)-3-(2-methylphenyl)propan-2-amine dihydrochloride Openeye Name: 1-(azepan-1-yl)-3-(o-tolyl)propan-2-amine dihydrochloride CAS Name: 1-(1-azepanyl)-3-(2-methylphenyl)-2-propanamine dihydrochloride IUPAC Name: 1-(azepan-1-yl)-3-(2-methylphenyl)propan-2-amine dihydrochloride Traditional Name: [1-(azepan-1-ylmethyl)-2-(o-tolyl)ethyl]amine dihydrochloride Formula: C16H28Cl2N2 MolecularWeight: 319.31292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(CN2CCCCCC2)N.Cl.Cl

Isomeric SMILES

CC1=CC=CC=C1CC(CN2CCCCCC2)N.Cl.Cl

InChI

InChI=1S/C16H26N2.2ClH/c1-14-8-4-5-9-15(14)12-16(17)13-18-10-6-2-3-7-11-18;;/h4-5,8-9,16H,2-3,6-7,10-13,17H2,1H3;2*1H