(2S)-2-[(4-methylphenyl)methylamino]-2-(4-propoxyphenyl)ethanenitrile

Systemtic Name: (2S)-2-[(4-methylphenyl)methylamino]-2-(4-propoxyphenyl)ethanenitrile Openeye Name: (2S)-2-(4-propoxyphenyl)-2-(p-tolylmethylamino)acetonitrile CAS Name: (2S)-2-[(4-methylphenyl)methylamino]-2-(4-propoxyphenyl)acetonitrile IUPAC Name: (2S)-2-[(4-methylphenyl)methylamino]-2-(4-propoxyphenyl)acetonitrile Traditional Name: (2S)-2-[(4-methylbenzyl)amino]-2-(4-propoxyphenyl)acetonitrile Formula: C19H22N2O MolecularWeight: 294.39078

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(C#N)NCC2=CC=C(C=C2)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)[C@@H](C#N)NCC2=CC=C(C=C2)C

InChI

InChI=1S/C19H22N2O/c1-3-12-22-18-10-8-17(9-11-18)19(13-20)21-14-16-6-4-15(2)5-7-16/h4-11,19,21H,3,12,14H2,1-2H3/t19-/m1/s1