(2S)-2-(3,4-dimethoxyphenyl)-2-[(4-methylphenyl)methylamino]ethanenitrile

Systemtic Name: (2S)-2-(3,4-dimethoxyphenyl)-2-[(4-methylphenyl)methylamino]ethanenitrile Openeye Name: (2S)-2-(3,4-dimethoxyphenyl)-2-(p-tolylmethylamino)acetonitrile CAS Name: (2S)-2-(3,4-dimethoxyphenyl)-2-[(4-methylphenyl)methylamino]acetonitrile IUPAC Name: (2S)-2-(3,4-dimethoxyphenyl)-2-[(4-methylphenyl)methylamino]acetonitrile Traditional Name: (2S)-2-(3,4-dimethoxyphenyl)-2-[(4-methylbenzyl)amino]acetonitrile Formula: C18H20N2O2 MolecularWeight: 296.3636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(C#N)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)CN[C@H](C#N)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C18H20N2O2/c1-13-4-6-14(7-5-13)12-20-16(11-19)15-8-9-17(21-2)18(10-15)22-3/h4-10,16,20H,12H2,1-3H3/t16-/m1/s1