3-[(3-butoxy-2-oxidanyl-propyl)-(phenylmethyl)amino]propanenitrile

Systemtic Name: 3-[(3-butoxy-2-oxidanyl-propyl)-(phenylmethyl)amino]propanenitrile Openeye Name: 3-[benzyl-(3-butoxy-2-hydroxy-propyl)amino]propanenitrile CAS Name: 3-[(3-butoxy-2-hydroxypropyl)-(phenylmethyl)amino]propanenitrile IUPAC Name: 3-[benzyl-(3-butoxy-2-hydroxypropyl)amino]propanenitrile Traditional Name: 3-[benzyl-(3-butoxy-2-hydroxy-propyl)amino]propionitrile Formula: C17H26N2O2 MolecularWeight: 290.40054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOCC(CN(CCC#N)CC1=CC=CC=C1)O

Isomeric SMILES

CCCCOCC(CN(CCC#N)CC1=CC=CC=C1)O

InChI

InChI=1S/C17H26N2O2/c1-2-3-12-21-15-17(20)14-19(11-7-10-18)13-16-8-5-4-6-9-16/h4-6,8-9,17,20H,2-3,7,11-15H2,1H3