3-[2-[(2S)-butan-2-yl]phenoxy]propanenitrile

Systemtic Name: 3-[2-[(2S)-butan-2-yl]phenoxy]propanenitrile Openeye Name: 3-[2-[(1S)-1-methylpropyl]phenoxy]propanenitrile CAS Name: 3-[2-[(2S)-butan-2-yl]phenoxy]propanenitrile IUPAC Name: 3-[2-[(2S)-butan-2-yl]phenoxy]propanenitrile Traditional Name: 3-[2-[(1S)-1-methylpropyl]phenoxy]propionitrile Formula: C13H17NO MolecularWeight: 203.28018

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1OCCC#N

Isomeric SMILES

CC[C@H](C)C1=CC=CC=C1OCCC#N

InChI

InChI=1S/C13H17NO/c1-3-11(2)12-7-4-5-8-13(12)15-10-6-9-14/h4-5,7-8,11H,3,6,10H2,1-2H3/t11-/m0/s1