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

Systemtic Name: 2-(azepan-1-yl)-1-phenyl-butan-1-amine Openeye Name: 2-(azepan-1-yl)-1-phenyl-butan-1-amine CAS Name: 2-(1-azepanyl)-1-phenyl-1-butanamine IUPAC Name: 2-(azepan-1-yl)-1-phenylbutan-1-amine Traditional Name: [2-(azepan-1-yl)-1-phenyl-butyl]amine Formula: C16H26N2 MolecularWeight: 246.39104

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C1=CC=CC=C1)N)N2CCCCCC2

Isomeric SMILES

CCC(C(C1=CC=CC=C1)N)N2CCCCCC2

InChI

InChI=1S/C16H26N2/c1-2-15(18-12-8-3-4-9-13-18)16(17)14-10-6-5-7-11-14/h5-7,10-11,15-16H,2-4,8-9,12-13,17H2,1H3