tert-butyl 4-oxidanyl-2-[4-[phenylmethoxycarbonyl-[3-(phenylmethoxycarbonylamino)propyl]amino]butylcarbamoyl]butanoate

Systemtic Name: tert-butyl 4-oxidanyl-2-[4-[phenylmethoxycarbonyl-[3-(phenylmethoxycarbonylamino)propyl]amino]butylcarbamoyl]butanoate Openeye Name: tert-butyl 2-[4-[benzyloxycarbonyl-[3-(benzyloxycarbonylamino)propyl]amino]butylcarbamoyl]-4-hydroxy-butanoate CAS Name: 4-hydroxy-2-[oxo-[4-[phenylmethoxycarbonyl-[3-(phenylmethoxycarbonylamino)propyl]amino]butylamino]methyl]butanoic acid tert-butyl ester IUPAC Name: tert-butyl 4-hydroxy-2-[4-[phenylmethoxycarbonyl-[3-(phenylmethoxycarbonylamino)propyl]amino]butylcarbamoyl]butanoate Traditional Name: 2-[4-[3-(benzyloxycarbonylamino)propyl-carbobenzoxy-amino]butylcarbamoyl]-4-hydroxy-butyric acid tert-butyl ester Formula: C32H45N3O8 MolecularWeight: 599.715

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CCO)C(=O)NCCCCN(CCCNC(=O)OCC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)C(CCO)C(=O)NCCCCN(CCCNC(=O)OCC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C32H45N3O8/c1-32(2,3)43-29(38)27(17-22-36)28(37)33-18-10-11-20-35(31(40)42-24-26-15-8-5-9-16-26)21-12-19-34-30(39)41-23-25-13-6-4-7-14-25/h4-9,13-16,27,36H,10-12,17-24H2,1-3H3,(H,33,37)(H,34,39)