3-[[(2R)-3-(2-tert-butyl-4-methoxy-phenoxy)-2-oxidanyl-propyl]-(2-methylpropyl)amino]propanenitrile

Systemtic Name: 3-[[(2R)-3-(2-tert-butyl-4-methoxy-phenoxy)-2-oxidanyl-propyl]-(2-methylpropyl)amino]propanenitrile Openeye Name: 3-[[(2R)-3-(2-tert-butyl-4-methoxy-phenoxy)-2-hydroxy-propyl]-isobutyl-amino]propanenitrile CAS Name: 3-[[(2R)-3-(2-tert-butyl-4-methoxyphenoxy)-2-hydroxypropyl]-(2-methylpropyl)amino]propanenitrile IUPAC Name: 3-[[(2R)-3-(2-tert-butyl-4-methoxyphenoxy)-2-hydroxypropyl]-(2-methylpropyl)amino]propanenitrile Traditional Name: 3-[[(2R)-3-(2-tert-butyl-4-methoxy-phenoxy)-2-hydroxy-propyl]-isobutyl-amino]propionitrile Formula: C21H34N2O3 MolecularWeight: 362.50626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CCC#N)CC(COC1=C(C=C(C=C1)OC)C(C)(C)C)O

Isomeric SMILES

CC(C)CN(CCC#N)C[C@H](COC1=C(C=C(C=C1)OC)C(C)(C)C)O

InChI

InChI=1S/C21H34N2O3/c1-16(2)13-23(11-7-10-22)14-17(24)15-26-20-9-8-18(25-6)12-19(20)21(3,4)5/h8-9,12,16-17,24H,7,11,13-15H2,1-6H3/t17-/m1/s1