3-[[1-(2-methoxy-5-methyl-phenyl)ethylamino]methyl]benzenecarbonitrile hydrochloride

Systemtic Name: 3-[[1-(2-methoxy-5-methyl-phenyl)ethylamino]methyl]benzenecarbonitrile hydrochloride Openeye Name: 3-[[1-(2-methoxy-5-methyl-phenyl)ethylamino]methyl]benzonitrile hydrochloride CAS Name: 3-[[1-(2-methoxy-5-methylphenyl)ethylamino]methyl]benzonitrile hydrochloride IUPAC Name: 3-[[1-(2-methoxy-5-methylphenyl)ethylamino]methyl]benzonitrile hydrochloride Traditional Name: 3-[[1-(2-methoxy-5-methyl-phenyl)ethylamino]methyl]benzonitrile hydrochloride Formula: C18H21ClN2O MolecularWeight: 316.82514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C(C)NCC2=CC=CC(=C2)C#N.Cl

Isomeric SMILES

CC1=CC(=C(C=C1)OC)C(C)NCC2=CC=CC(=C2)C#N.Cl

InChI

InChI=1S/C18H20N2O.ClH/c1-13-7-8-18(21-3)17(9-13)14(2)20-12-16-6-4-5-15(10-16)11-19;/h4-10,14,20H,12H2,1-3H3;1H