2-phenoxyethyl 4-[2-[bis(phenylmethoxy)phosphorylmethyl]-4-oxidanylidene-4-phenylmethoxy-butanoyl]piperazine-1-carboxylate

Systemtic Name: 2-phenoxyethyl 4-[2-[bis(phenylmethoxy)phosphorylmethyl]-4-oxidanylidene-4-phenylmethoxy-butanoyl]piperazine-1-carboxylate Openeye Name: 2-phenoxyethyl 4-[4-benzyloxy-2-(dibenzyloxyphosphorylmethyl)-4-oxo-butanoyl]piperazine-1-carboxylate CAS Name: 4-[2-[bis(phenylmethoxy)phosphorylmethyl]-1,4-dioxo-4-phenylmethoxybutyl]-1-piperazinecarboxylic acid 2-phenoxyethyl ester IUPAC Name: 2-phenoxyethyl 4-[2-[bis(phenylmethoxy)phosphorylmethyl]-4-oxo-4-phenylmethoxybutanoyl]piperazine-1-carboxylate Traditional Name: 4-[4-benzoxy-2-(dibenzoxyphosphorylmethyl)-4-keto-butanoyl]piperazine-1-carboxylic acid 2-phenoxyethyl ester Formula: C39H43N2O9P MolecularWeight: 714.740481

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C(CC(=O)OCC2=CC=CC=C2)CP(=O)(OCC3=CC=CC=C3)OCC4=CC=CC=C4)C(=O)OCCOC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C(=O)C(CC(=O)OCC2=CC=CC=C2)CP(=O)(OCC3=CC=CC=C3)OCC4=CC=CC=C4)C(=O)OCCOC5=CC=CC=C5

InChI

InChI=1S/C39H43N2O9P/c42-37(48-28-32-13-5-1-6-14-32)27-35(31-51(45,49-29-33-15-7-2-8-16-33)50-30-34-17-9-3-10-18-34)38(43)40-21-23-41(24-22-40)39(44)47-26-25-46-36-19-11-4-12-20-36/h1-20,35H,21-31H2