1,7-diphenylheptan-4-yl (2S)-1-[[(2R)-1-phenyl-3-phosphonooxy-propan-2-yl]carbamoyl]piperidine-2-carboxylate

Systemtic Name: 1,7-diphenylheptan-4-yl (2S)-1-[[(2R)-1-phenyl-3-phosphonooxy-propan-2-yl]carbamoyl]piperidine-2-carboxylate Openeye Name: [4-phenyl-1-(3-phenylpropyl)butyl] (2S)-1-[[(1R)-1-benzyl-2-phosphonooxy-ethyl]carbamoyl]piperidine-2-carboxylate CAS Name: (2S)-1-[oxo-[[(2R)-1-phenyl-3-phosphonooxypropan-2-yl]amino]methyl]-2-piperidinecarboxylic acid 1,7-diphenylheptan-4-yl ester IUPAC Name: 1,7-diphenylheptan-4-yl (2S)-1-[[(2R)-1-phenyl-3-phosphonooxypropan-2-yl]carbamoyl]piperidine-2-carboxylate Traditional Name: (2S)-1-[[(1R)-1-benzyl-2-phosphonooxy-ethyl]carbamoyl]pipecolinic acid [4-phenyl-1-(3-phenylpropyl)butyl] ester Formula: C35H45N2O7P MolecularWeight: 636.714761

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)OC(CCCC2=CC=CC=C2)CCCC3=CC=CC=C3)C(=O)NC(CC4=CC=CC=C4)COP(=O)(O)O

Isomeric SMILES

C1CCN([C@@H](C1)C(=O)OC(CCCC2=CC=CC=C2)CCCC3=CC=CC=C3)C(=O)N[C@H](CC4=CC=CC=C4)COP(=O)(O)O

InChI

InChI=1S/C35H45N2O7P/c38-34(44-32(22-12-20-28-14-4-1-5-15-28)23-13-21-29-16-6-2-7-17-29)33-24-10-11-25-37(33)35(39)36-31(27-43-45(40,41)42)26-30-18-8-3-9-19-30/h1-9,14-19,31-33H,10-13,20-27H2,(H,36,39)(H2,40,41,42)/t31-,33+/m1/s1