2-(azepan-1-yl)-2-(3,4-dimethoxyphenyl)ethanamine

Systemtic Name: 2-(azepan-1-yl)-2-(3,4-dimethoxyphenyl)ethanamine Openeye Name: 2-(azepan-1-yl)-2-(3,4-dimethoxyphenyl)ethanamine CAS Name: 2-(1-azepanyl)-2-(3,4-dimethoxyphenyl)ethanamine IUPAC Name: 2-(azepan-1-yl)-2-(3,4-dimethoxyphenyl)ethanamine Traditional Name: [2-(azepan-1-yl)-2-(3,4-dimethoxyphenyl)ethyl]amine Formula: C16H26N2O2 MolecularWeight: 278.38984

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CN)N2CCCCCC2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(CN)N2CCCCCC2)OC

InChI

InChI=1S/C16H26N2O2/c1-19-15-8-7-13(11-16(15)20-2)14(12-17)18-9-5-3-4-6-10-18/h7-8,11,14H,3-6,9-10,12,17H2,1-2H3