(2S)-2-(furan-2-ylmethylamino)-2-(3-propoxyphenyl)ethanenitrile

Systemtic Name: (2S)-2-(furan-2-ylmethylamino)-2-(3-propoxyphenyl)ethanenitrile Openeye Name: (2S)-2-(2-furylmethylamino)-2-(3-propoxyphenyl)acetonitrile CAS Name: (2S)-2-(2-furanylmethylamino)-2-(3-propoxyphenyl)acetonitrile IUPAC Name: (2S)-2-(furan-2-ylmethylamino)-2-(3-propoxyphenyl)acetonitrile Traditional Name: (2S)-2-(2-furfurylamino)-2-(3-propoxyphenyl)acetonitrile Formula: C16H18N2O2 MolecularWeight: 270.32632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(C#N)NCC2=CC=CO2

Isomeric SMILES

CCCOC1=CC=CC(=C1)[C@@H](C#N)NCC2=CC=CO2

InChI

InChI=1S/C16H18N2O2/c1-2-8-19-14-6-3-5-13(10-14)16(11-17)18-12-15-7-4-9-20-15/h3-7,9-10,16,18H,2,8,12H2,1H3/t16-/m1/s1