4-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-1-(4-methoxy-3-oxidanyl-phenyl)cyclohexane-1-carbonitrile

Systemtic Name: 4-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-1-(4-methoxy-3-oxidanyl-phenyl)cyclohexane-1-carbonitrile Openeye Name: 4-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-1-(3-hydroxy-4-methoxy-phenyl)cyclohexanecarbonitrile CAS Name: 4-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-1-(3-hydroxy-4-methoxyphenyl)-1-cyclohexanecarbonitrile IUPAC Name: 4-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-1-(3-hydroxy-4-methoxyphenyl)cyclohexane-1-carbonitrile Traditional Name: 4-[homoveratryl(methyl)amino]-1-(3-hydroxy-4-methoxy-phenyl)cyclohexanecarbonitrile Formula: C25H32N2O4 MolecularWeight: 424.53258

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=C(C=C1)OC)OC)C2CCC(CC2)(C#N)C3=CC(=C(C=C3)OC)O

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)C2CCC(CC2)(C#N)C3=CC(=C(C=C3)OC)O

InChI

InChI=1S/C25H32N2O4/c1-27(14-11-18-5-7-23(30-3)24(15-18)31-4)20-9-12-25(17-26,13-10-20)19-6-8-22(29-2)21(28)16-19/h5-8,15-16,20,28H,9-14H2,1-4H3