(1S,3R)-3-azanyl-1-(3-cyclopentyloxy-4-methoxy-phenyl)cyclohexane-1-carbonitrile hydrochloride

Systemtic Name: (1S,3R)-3-azanyl-1-(3-cyclopentyloxy-4-methoxy-phenyl)cyclohexane-1-carbonitrile hydrochloride Openeye Name: (1S,3R)-3-amino-1-[3-(cyclopentoxy)-4-methoxy-phenyl]cyclohexanecarbonitrile hydrochloride CAS Name: (1S,3R)-3-amino-1-(3-cyclopentyloxy-4-methoxyphenyl)-1-cyclohexanecarbonitrile hydrochloride IUPAC Name: (1S,3R)-3-amino-1-(3-cyclopentyloxy-4-methoxyphenyl)cyclohexane-1-carbonitrile hydrochloride Traditional Name: (1S,3R)-3-amino-1-[3-(cyclopentoxy)-4-methoxy-phenyl]cyclohexanecarbonitrile hydrochloride Formula: C19H27ClN2O2 MolecularWeight: 350.88288

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(CCCC(C2)N)C#N)OC3CCCC3.Cl

Isomeric SMILES

COC1=C(C=C(C=C1)[C@@]2(CCC[C@H](C2)N)C#N)OC3CCCC3.Cl

InChI

InChI=1S/C19H26N2O2.ClH/c1-22-17-9-8-14(11-18(17)23-16-6-2-3-7-16)19(13-20)10-4-5-15(21)12-19;/h8-9,11,15-16H,2-7,10,12,21H2,1H3;1H/t15-,19-;/m1./s1