tert-butyl (4S)-3-oxidanylidene-4,8-bis(phenylmethoxycarbonylamino)octanoate

Systemtic Name: tert-butyl (4S)-3-oxidanylidene-4,8-bis(phenylmethoxycarbonylamino)octanoate Openeye Name: tert-butyl (4S)-4,8-bis(benzyloxycarbonylamino)-3-oxo-octanoate CAS Name: (4S)-3-oxo-4,8-bis(phenylmethoxycarbonylamino)octanoic acid tert-butyl ester IUPAC Name: tert-butyl (4S)-3-oxo-4,8-bis(phenylmethoxycarbonylamino)octanoate Traditional Name: (4S)-4,8-bis(benzyloxycarbonylamino)-3-keto-caprylic acid tert-butyl ester Formula: C28H36N2O7 MolecularWeight: 512.59464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(=O)C(CCCCNC(=O)OCC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)CC(=O)[C@H](CCCCNC(=O)OCC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C28H36N2O7/c1-28(2,3)37-25(32)18-24(31)23(30-27(34)36-20-22-14-8-5-9-15-22)16-10-11-17-29-26(33)35-19-21-12-6-4-7-13-21/h4-9,12-15,23H,10-11,16-20H2,1-3H3,(H,29,33)(H,30,34)/t23-/m0/s1