2-[[(2S)-1-(2-diphenylphosphanyl-6-methoxy-phenyl)pyrrolidin-2-yl]methyl-(2-dodecanoyloxyethyl)amino]ethyl dodecanoate

Systemtic Name: 2-[[(2S)-1-(2-diphenylphosphanyl-6-methoxy-phenyl)pyrrolidin-2-yl]methyl-(2-dodecanoyloxyethyl)amino]ethyl dodecanoate Openeye Name: 2-[[(2S)-1-(2-diphenylphosphanyl-6-methoxy-phenyl)pyrrolidin-2-yl]methyl-(2-dodecanoyloxyethyl)amino]ethyl dodecanoate CAS Name: dodecanoic acid 2-[[(2S)-1-(2-diphenylphosphino-6-methoxyphenyl)-2-pyrrolidinyl]methyl-[2-(1-oxododecoxy)ethyl]amino]ethyl ester IUPAC Name: 2-[[(2S)-1-(2-diphenylphosphanyl-6-methoxyphenyl)pyrrolidin-2-yl]methyl-(2-dodecanoyloxyethyl)amino]ethyl dodecanoate Traditional Name: lauric acid 2-[[(2S)-1-(2-diphenylphosphino-6-methoxy-phenyl)pyrrolidin-2-yl]methyl-(2-lauroyloxyethyl)amino]ethyl ester Formula: C52H79N2O5P MolecularWeight: 843.167821

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OCCN(CCOC(=O)CCCCCCCCCCC)CC1CCCN1C2=C(C=CC=C2P(C3=CC=CC=C3)C4=CC=CC=C4)OC

Isomeric SMILES

CCCCCCCCCCCC(=O)OCCN(CCOC(=O)CCCCCCCCCCC)C[C@@H]1CCCN1C2=C(C=CC=C2P(C3=CC=CC=C3)C4=CC=CC=C4)OC

InChI

InChI=1S/C52H79N2O5P/c1-4-6-8-10-12-14-16-18-26-37-50(55)58-42-40-53(41-43-59-51(56)38-27-19-17-15-13-11-9-7-5-2)44-45-30-29-39-54(45)52-48(57-3)35-28-36-49(52)60(46-31-22-20-23-32-46)47-33-24-21-25-34-47/h20-25,28,31-36,45H,4-19,26-27,29-30,37-44H2,1-3H3/t45-/m0/s1