1-(azepan-1-yl)-4-phenyl-butan-2-amine dihydrochloride

Systemtic Name: 1-(azepan-1-yl)-4-phenyl-butan-2-amine dihydrochloride Openeye Name: 1-(azepan-1-yl)-4-phenyl-butan-2-amine dihydrochloride CAS Name: 1-(1-azepanyl)-4-phenyl-2-butanamine dihydrochloride IUPAC Name: 1-(azepan-1-yl)-4-phenylbutan-2-amine dihydrochloride Traditional Name: [1-(azepan-1-ylmethyl)-3-phenyl-propyl]amine dihydrochloride Formula: C16H28Cl2N2 MolecularWeight: 319.31292

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC(CCC2=CC=CC=C2)N.Cl.Cl

Isomeric SMILES

C1CCCN(CC1)CC(CCC2=CC=CC=C2)N.Cl.Cl

InChI

InChI=1S/C16H26N2.2ClH/c17-16(11-10-15-8-4-3-5-9-15)14-18-12-6-1-2-7-13-18;;/h3-5,8-9,16H,1-2,6-7,10-14,17H2;2*1H