2-[[cyanomethyl(diphenoxyphosphorylmethyl)amino]methyl-(diphenoxyphosphorylmethyl)amino]ethanenitrile

Systemtic Name: 2-[[cyanomethyl(diphenoxyphosphorylmethyl)amino]methyl-(diphenoxyphosphorylmethyl)amino]ethanenitrile Openeye Name: 2-[[cyanomethyl(diphenoxyphosphorylmethyl)amino]methyl-(diphenoxyphosphorylmethyl)amino]acetonitrile CAS Name: 2-[[cyanomethyl(diphenoxyphosphorylmethyl)amino]methyl-(diphenoxyphosphorylmethyl)amino]acetonitrile IUPAC Name: 2-[[cyanomethyl(diphenoxyphosphorylmethyl)amino]methyl-(diphenoxyphosphorylmethyl)amino]acetonitrile Traditional Name: 2-[[cyanomethyl(diphenoxyphosphorylmethyl)amino]methyl-(diphenoxyphosphorylmethyl)amino]acetonitrile Formula: C31H30N4O6P2 MolecularWeight: 616.540622

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OP(=O)(CN(CC#N)CN(CC#N)CP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)OP(=O)(CN(CC#N)CN(CC#N)CP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C31H30N4O6P2/c32-21-23-34(26-42(36,38-28-13-5-1-6-14-28)39-29-15-7-2-8-16-29)25-35(24-22-33)27-43(37,40-30-17-9-3-10-18-30)41-31-19-11-4-12-20-31/h1-20H,23-27H2