(phenylmethyl) 1-[(2R,3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-4-phenyl-butanoyl]piperidine-4-carboxylate

Systemtic Name: (phenylmethyl) 1-[(2R,3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-4-phenyl-butanoyl]piperidine-4-carboxylate Openeye Name: benzyl 1-[(2R,3S)-3-(tert-butoxycarbonylamino)-2-hydroxy-4-phenyl-butanoyl]piperidine-4-carboxylate CAS Name: 1-[(2R,3S)-2-hydroxy-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxo-4-phenylbutyl]-4-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1-[(2R,3S)-2-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-phenylbutanoyl]piperidine-4-carboxylate Traditional Name: 1-[(2R,3S)-3-(tert-butoxycarbonylamino)-2-hydroxy-4-phenyl-butanoyl]isonipecotic acid benzyl ester Formula: C28H36N2O6 MolecularWeight: 496.59524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(C(=O)N2CCC(CC2)C(=O)OCC3=CC=CC=C3)O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)[C@H](C(=O)N2CCC(CC2)C(=O)OCC3=CC=CC=C3)O

InChI

InChI=1S/C28H36N2O6/c1-28(2,3)36-27(34)29-23(18-20-10-6-4-7-11-20)24(31)25(32)30-16-14-22(15-17-30)26(33)35-19-21-12-8-5-9-13-21/h4-13,22-24,31H,14-19H2,1-3H3,(H,29,34)/t23-,24+/m0/s1