(phenylmethyl) N-[13-cyano-12-oxidanylidene-13-(triphenyl-$l^{5}-phosphanylidene)tridecyl]carbamate

Systemtic Name: (phenylmethyl) N-[13-cyano-12-oxidanylidene-13-(triphenyl-$l^{5}-phosphanylidene)tridecyl]carbamate Openeye Name: benzyl N-[13-cyano-12-oxo-13-(triphenyl-$l^{5}-phosphanylidene)tridecyl]carbamate CAS Name: N-(13-cyano-12-oxo-13-triphenylphosphoranylidenetridecyl)carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[13-cyano-12-oxo-13-(triphenyl-$l^{5}-phosphanylidene)tridecyl]carbamate Traditional Name: N-(13-cyano-12-keto-13-triphenylphosphoranylidene-tridecyl)carbamic acid benzyl ester Formula: C40H45N2O3P MolecularWeight: 632.770661

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCCCCCCCCCCCC(=O)C(=P(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C#N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCCCCCCCCCCCC(=O)C(=P(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C40H45N2O3P/c41-32-39(46(35-24-14-9-15-25-35,36-26-16-10-17-27-36)37-28-18-11-19-29-37)38(43)30-20-6-4-2-1-3-5-7-21-31-42-40(44)45-33-34-22-12-8-13-23-34/h8-19,22-29H,1-7,20-21,30-31,33H2,(H,42,44)