(2S)-2-[(phenylmethyl)amino]-2-(3-propoxyphenyl)ethanenitrile

Systemtic Name: (2S)-2-[(phenylmethyl)amino]-2-(3-propoxyphenyl)ethanenitrile Openeye Name: (2S)-2-(benzylamino)-2-(3-propoxyphenyl)acetonitrile CAS Name: (2S)-2-[(phenylmethyl)amino]-2-(3-propoxyphenyl)acetonitrile IUPAC Name: (2S)-2-(benzylamino)-2-(3-propoxyphenyl)acetonitrile Traditional Name: (2S)-2-(benzylamino)-2-(3-propoxyphenyl)acetonitrile Formula: C18H20N2O MolecularWeight: 280.3642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O/c1-2-11-21-17-10-6-9-16(12-17)18(13-19)20-14-15-7-4-3-5-8-15/h3-10,12,18,20H,2,11,14H2,1H3/t18-/m1/s1