(2S)-2-(pentylamino)-2-(4-propoxyphenyl)ethanenitrile

Systemtic Name: (2S)-2-(pentylamino)-2-(4-propoxyphenyl)ethanenitrile Openeye Name: (2S)-2-(pentylamino)-2-(4-propoxyphenyl)acetonitrile CAS Name: (2S)-2-(pentylamino)-2-(4-propoxyphenyl)acetonitrile IUPAC Name: (2S)-2-(pentylamino)-2-(4-propoxyphenyl)acetonitrile Traditional Name: (2S)-2-(amylamino)-2-(4-propoxyphenyl)acetonitrile Formula: C16H24N2O MolecularWeight: 260.37456

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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