N-diphenoxyphosphoryl-2-[4-(2-methylpropyl)phenyl]-1-pyrrolidin-1-yl-propan-1-imine

Systemtic Name: N-diphenoxyphosphoryl-2-[4-(2-methylpropyl)phenyl]-1-pyrrolidin-1-yl-propan-1-imine Openeye Name: N-diphenoxyphosphoryl-2-(4-isobutylphenyl)-1-pyrrolidin-1-yl-propan-1-imine CAS Name: N-diphenoxyphosphoryl-2-[4-(2-methylpropyl)phenyl]-1-(1-pyrrolidinyl)-1-propanimine IUPAC Name: N-diphenoxyphosphoryl-2-[4-(2-methylpropyl)phenyl]-1-pyrrolidin-1-ylpropan-1-imine Traditional Name: (Z)-diphenoxyphosphoryl-[2-(4-isobutylphenyl)-1-pyrrolidino-propylidene]amine Formula: C29H35N2O3P MolecularWeight: 490.573561

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(C)C(=NP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3)N4CCCC4

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C(C)/C(=N/P(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3)/N4CCCC4

InChI

InChI=1S/C29H35N2O3P/c1-23(2)22-25-16-18-26(19-17-25)24(3)29(31-20-10-11-21-31)30-35(32,33-27-12-6-4-7-13-27)34-28-14-8-5-9-15-28/h4-9,12-19,23-24H,10-11,20-22H2,1-3H3/b30-29-