tert-butyl 3-[[[1-[3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]pyrrolidin-2-yl]carbonylamino]methyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[[[1-[3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]pyrrolidin-2-yl]carbonylamino]methyl]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[[[1-[2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]pyrrolidine-2-carbonyl]amino]methyl]piperidine-1-carboxylate CAS Name: 3-[[[oxo-[1-[1-oxo-3-phenyl-2-(phenylmethoxycarbonylamino)propyl]-2-pyrrolidinyl]methyl]amino]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[[1-[3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]pyrrolidine-2-carbonyl]amino]methyl]piperidine-1-carboxylate Traditional Name: 3-[[[1-[2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]prolyl]amino]methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C33H44N4O6 MolecularWeight: 592.72566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)CNC(=O)C2CCCN2C(=O)C(CC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1)CNC(=O)C2CCCN2C(=O)C(CC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C33H44N4O6/c1-33(2,3)43-32(41)36-18-10-16-26(22-36)21-34-29(38)28-17-11-19-37(28)30(39)27(20-24-12-6-4-7-13-24)35-31(40)42-23-25-14-8-5-9-15-25/h4-9,12-15,26-28H,10-11,16-23H2,1-3H3,(H,34,38)(H,35,40)