1-(3,4-dimethoxyphenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]cyclooctane-1-carbonitrile

Systemtic Name: 1-(3,4-dimethoxyphenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]cyclooctane-1-carbonitrile Openeye Name: 1-(3,4-dimethoxyphenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]cyclooctanecarbonitrile CAS Name: 1-(3,4-dimethoxyphenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-1-cyclooctanecarbonitrile IUPAC Name: 1-(3,4-dimethoxyphenyl)-5-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]cyclooctane-1-carbonitrile Traditional Name: 1-(3,4-dimethoxyphenyl)-5-[homoveratryl(methyl)amino]cyclooctanecarbonitrile Formula: C28H38N2O4 MolecularWeight: 466.61232

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=C(C=C1)OC)OC)C2CCCC(CCC2)(C#N)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)C2CCCC(CCC2)(C#N)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C28H38N2O4/c1-30(17-14-21-10-12-24(31-2)26(18-21)33-4)23-8-6-15-28(20-29,16-7-9-23)22-11-13-25(32-3)27(19-22)34-5/h10-13,18-19,23H,6-9,14-17H2,1-5H3