tert-butyl (3S)-5-diphenylphosphoryloxy-3-[[(2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-4-oxidanylidene-pentanoate

Systemtic Name: tert-butyl (3S)-5-diphenylphosphoryloxy-3-[[(2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-4-oxidanylidene-pentanoate Openeye Name: tert-butyl (3S)-3-[[(2S)-2-(benzyloxycarbonylamino)-3-methyl-butanoyl]amino]-5-diphenylphosphoryloxy-4-oxo-pentanoate CAS Name: (3S)-5-diphenylphosphoryloxy-3-[[(2S)-3-methyl-1-oxo-2-(phenylmethoxycarbonylamino)butyl]amino]-4-oxopentanoic acid tert-butyl ester IUPAC Name: tert-butyl (3S)-5-diphenylphosphoryloxy-3-[[(2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]-4-oxopentanoate Traditional Name: (3S)-3-[[(2S)-2-(benzyloxycarbonylamino)-3-methyl-butanoyl]amino]-5-diphenylphosphoryloxy-4-keto-valeric acid tert-butyl ester Formula: C34H41N2O8P MolecularWeight: 636.671701

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(CC(=O)OC(C)(C)C)C(=O)COP(=O)(C1=CC=CC=C1)C2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)[C@@H](C(=O)N[C@@H](CC(=O)OC(C)(C)C)C(=O)COP(=O)(C1=CC=CC=C1)C2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C34H41N2O8P/c1-24(2)31(36-33(40)42-22-25-15-9-6-10-16-25)32(39)35-28(21-30(38)44-34(3,4)5)29(37)23-43-45(41,26-17-11-7-12-18-26)27-19-13-8-14-20-27/h6-20,24,28,31H,21-23H2,1-5H3,(H,35,39)(H,36,40)/t28-,31-/m0/s1