4-[bis(4-methoxyphenyl)-phenyl-methyl]sulfanylbutyl bis(2-cyanoethyl) phosphate

Systemtic Name: 4-[bis(4-methoxyphenyl)-phenyl-methyl]sulfanylbutyl bis(2-cyanoethyl) phosphate Openeye Name: 4-[bis(4-methoxyphenyl)-phenyl-methyl]sulfanylbutyl bis(2-cyanoethyl) phosphate CAS Name: phosphoric acid 4-[[bis(4-methoxyphenyl)-phenylmethyl]thio]butyl bis(2-cyanoethyl) ester IUPAC Name: 4-[bis(4-methoxyphenyl)-phenylmethyl]sulfanylbutyl bis(2-cyanoethyl) phosphate Traditional Name: phosphoric acid 4-[[bis(4-methoxyphenyl)-phenyl-methyl]thio]butyl bis(2-cyanoethyl) ester Formula: C31H35N2O6PS MolecularWeight: 594.658161

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)SCCCCOP(=O)(OCCC#N)OCCC#N

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)SCCCCOP(=O)(OCCC#N)OCCC#N

InChI

InChI=1S/C31H35N2O6PS/c1-35-29-16-12-27(13-17-29)31(26-10-4-3-5-11-26,28-14-18-30(36-2)19-15-28)41-25-7-6-22-37-40(34,38-23-8-20-32)39-24-9-21-33/h3-5,10-19H,6-9,22-25H2,1-2H3