2-[2-(3,4-dimethoxyphenyl)ethyl]-1-phenethyl-piperidine bromide

Systemtic Name: 2-[2-(3,4-dimethoxyphenyl)ethyl]-1-phenethyl-piperidine bromide Openeye Name: 2-[2-(3,4-dimethoxyphenyl)ethyl]-1-phenethyl-piperidine bromide CAS Name: 2-[2-(3,4-dimethoxyphenyl)ethyl]-1-phenethylpiperidine bromide IUPAC Name: 2-[2-(3,4-dimethoxyphenyl)ethyl]-1-phenethylpiperidine bromide Traditional Name: 2-homoveratryl-1-phenethyl-piperidine bromide Formula: C23H31BrNO2- MolecularWeight: 433.40174

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC2CCCCN2CCC3=CC=CC=C3)OC.[Br-]

Isomeric SMILES

COC1=C(C=C(C=C1)CCC2CCCCN2CCC3=CC=CC=C3)OC.[Br-]

InChI

InChI=1S/C23H31NO2.BrH/c1-25-22-14-12-20(18-23(22)26-2)11-13-21-10-6-7-16-24(21)17-15-19-8-4-3-5-9-19;/h3-5,8-9,12,14,18,21H,6-7,10-11,13,15-17H2,1-2H3;1H/p-1