2-[(3,4-dimethoxyphenyl)methyl]-1-methyl-azepane

Systemtic Name: 2-[(3,4-dimethoxyphenyl)methyl]-1-methyl-azepane Openeye Name: 2-[(3,4-dimethoxyphenyl)methyl]-1-methyl-azepane CAS Name: 2-[(3,4-dimethoxyphenyl)methyl]-1-methylazepane IUPAC Name: 2-[(3,4-dimethoxyphenyl)methyl]-1-methylazepane Traditional Name: 1-methyl-2-veratryl-azepane Formula: C16H25NO2 MolecularWeight: 263.3752

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCCCC1CC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CN1CCCCCC1CC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C16H25NO2/c1-17-10-6-4-5-7-14(17)11-13-8-9-15(18-2)16(12-13)19-3/h8-9,12,14H,4-7,10-11H2,1-3H3