tert-butyl 4-[2-naphthalen-2-ylethyl-[[(3S)-1-oxidanyl-2-oxidanylidene-7-(phenylmethoxycarbonylamino)heptan-3-yl]carbamoyl]carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-naphthalen-2-ylethyl-[[(3S)-1-oxidanyl-2-oxidanylidene-7-(phenylmethoxycarbonylamino)heptan-3-yl]carbamoyl]carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[(1S)-5-(benzyloxycarbonylamino)-1-(2-hydroxyacetyl)pentyl]carbamoyl-[2-(2-naphthyl)ethyl]carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[[[[(3S)-1-hydroxy-2-oxo-7-(phenylmethoxycarbonylamino)heptan-3-yl]amino]-oxomethyl]-[2-(2-naphthalenyl)ethyl]amino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[(3S)-1-hydroxy-2-oxo-7-(phenylmethoxycarbonylamino)heptan-3-yl]carbamoyl-(2-naphthalen-2-ylethyl)carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[[(1S)-5-(benzyloxycarbonylamino)-1-glycoloyl-pentyl]carbamoyl-[2-(2-naphthyl)ethyl]carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C39H50N4O8 MolecularWeight: 702.8363

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)N(CCC2=CC3=CC=CC=C3C=C2)C(=O)NC(CCCCNC(=O)OCC4=CC=CC=C4)C(=O)CO

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)N(CCC2=CC3=CC=CC=C3C=C2)C(=O)N[C@@H](CCCCNC(=O)OCC4=CC=CC=C4)C(=O)CO

InChI

InChI=1S/C39H50N4O8/c1-39(2,3)51-38(49)42-22-19-31(20-23-42)35(46)43(24-18-28-16-17-30-13-7-8-14-32(30)25-28)36(47)41-33(34(45)26-44)15-9-10-21-40-37(48)50-27-29-11-5-4-6-12-29/h4-8,11-14,16-17,25,31,33,44H,9-10,15,18-24,26-27H2,1-3H3,(H,40,48)(H,41,47)/t33-/m0/s1