(2S)-2-[(phenylmethyl)amino]-2-(3-propan-2-yloxyphenyl)ethanenitrile

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)C(C#N)NCC2=CC=CC=C2

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)[C@@H](C#N)NCC2=CC=CC=C2

InChI

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