3-[[1-(3-methoxy-4-propan-2-yloxy-phenyl)ethylamino]methyl]benzenecarbonitrile hydrochloride

Systemtic Name: 3-[[1-(3-methoxy-4-propan-2-yloxy-phenyl)ethylamino]methyl]benzenecarbonitrile hydrochloride Openeye Name: 3-[[1-(4-isopropoxy-3-methoxy-phenyl)ethylamino]methyl]benzonitrile hydrochloride CAS Name: 3-[[1-(3-methoxy-4-propan-2-yloxyphenyl)ethylamino]methyl]benzonitrile hydrochloride IUPAC Name: 3-[[1-(3-methoxy-4-propan-2-yloxyphenyl)ethylamino]methyl]benzonitrile hydrochloride Traditional Name: 3-[[1-(4-isopropoxy-3-methoxy-phenyl)ethylamino]methyl]benzonitrile hydrochloride Formula: C20H25ClN2O2 MolecularWeight: 360.8777

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C(C)NCC2=CC=CC(=C2)C#N)OC.Cl

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C(C)NCC2=CC=CC(=C2)C#N)OC.Cl

InChI

InChI=1S/C20H24N2O2.ClH/c1-14(2)24-19-9-8-18(11-20(19)23-4)15(3)22-13-17-7-5-6-16(10-17)12-21;/h5-11,14-15,22H,13H2,1-4H3;1H