N-[2-(3,4-dimethoxyphenyl)ethyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine Traditional Name: homoveratryl(3,4,5,6-tetrahydro-2H-azepin-7-yl)amine Formula: C16H24N2O2 MolecularWeight: 276.37396

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC2=NCCCCC2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC2=NCCCCC2)OC

InChI

InChI=1S/C16H24N2O2/c1-19-14-8-7-13(12-15(14)20-2)9-11-18-16-6-4-3-5-10-17-16/h7-8,12H,3-6,9-11H2,1-2H3,(H,17,18)