4-butyl-1-(3,4-dimethoxyphenyl)-4-(propan-2-ylamino)cyclohexane-1-carbonitrile hydrochloride

Systemtic Name: 4-butyl-1-(3,4-dimethoxyphenyl)-4-(propan-2-ylamino)cyclohexane-1-carbonitrile hydrochloride Openeye Name: 4-butyl-1-(3,4-dimethoxyphenyl)-4-(isopropylamino)cyclohexanecarbonitrile hydrochloride CAS Name: 4-butyl-1-(3,4-dimethoxyphenyl)-4-(propan-2-ylamino)-1-cyclohexanecarbonitrile hydrochloride IUPAC Name: 4-butyl-1-(3,4-dimethoxyphenyl)-4-(propan-2-ylamino)cyclohexane-1-carbonitrile hydrochloride Traditional Name: 4-butyl-1-(3,4-dimethoxyphenyl)-4-(isopropylamino)cyclohexanecarbonitrile hydrochloride Formula: C22H35ClN2O2 MolecularWeight: 394.9785

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CCC(CC1)(C#N)C2=CC(=C(C=C2)OC)OC)NC(C)C.Cl

Isomeric SMILES

CCCCC1(CCC(CC1)(C#N)C2=CC(=C(C=C2)OC)OC)NC(C)C.Cl

InChI

InChI=1S/C22H34N2O2.ClH/c1-6-7-10-22(24-17(2)3)13-11-21(16-23,12-14-22)18-8-9-19(25-4)20(15-18)26-5;/h8-9,15,17,24H,6-7,10-14H2,1-5H3;1H