2-[4-[3-(dibutylamino)-2-oxidanyl-propoxy]phenyl]ethanenitrile

Systemtic Name: 2-[4-[3-(dibutylamino)-2-oxidanyl-propoxy]phenyl]ethanenitrile Openeye Name: 2-[4-[3-(dibutylamino)-2-hydroxy-propoxy]phenyl]acetonitrile CAS Name: 2-[4-[3-(dibutylamino)-2-hydroxypropoxy]phenyl]acetonitrile IUPAC Name: 2-[4-[3-(dibutylamino)-2-hydroxypropoxy]phenyl]acetonitrile Traditional Name: 2-[4-[3-(dibutylamino)-2-hydroxy-propoxy]phenyl]acetonitrile Formula: C19H30N2O2 MolecularWeight: 318.4537

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CC(COC1=CC=C(C=C1)CC#N)O

Isomeric SMILES

CCCCN(CCCC)CC(COC1=CC=C(C=C1)CC#N)O

InChI

InChI=1S/C19H30N2O2/c1-3-5-13-21(14-6-4-2)15-18(22)16-23-19-9-7-17(8-10-19)11-12-20/h7-10,18,22H,3-6,11,13-16H2,1-2H3