(2S)-2-(pentylamino)-2-(3-propan-2-yloxyphenyl)ethanenitrile

Systemtic Name: (2S)-2-(pentylamino)-2-(3-propan-2-yloxyphenyl)ethanenitrile Openeye Name: (2S)-2-(3-isopropoxyphenyl)-2-(pentylamino)acetonitrile CAS Name: (2S)-2-(pentylamino)-2-(3-propan-2-yloxyphenyl)acetonitrile IUPAC Name: (2S)-2-(pentylamino)-2-(3-propan-2-yloxyphenyl)acetonitrile Traditional Name: (2S)-2-(amylamino)-2-(3-isopropoxyphenyl)acetonitrile Formula: C16H24N2O MolecularWeight: 260.37456

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(C#N)C1=CC(=CC=C1)OC(C)C

Isomeric SMILES

CCCCCN[C@H](C#N)C1=CC(=CC=C1)OC(C)C

InChI

InChI=1S/C16H24N2O/c1-4-5-6-10-18-16(12-17)14-8-7-9-15(11-14)19-13(2)3/h7-9,11,13,16,18H,4-6,10H2,1-3H3/t16-/m1/s1