methyl (2S)-3-[4-acetyloxy-3,5-bis(acetyloxymethyl)phenyl]-2-(phenylmethoxycarbonylamino)propanoate

Systemtic Name: methyl (2S)-3-[4-acetyloxy-3,5-bis(acetyloxymethyl)phenyl]-2-(phenylmethoxycarbonylamino)propanoate Openeye Name: methyl (2S)-3-[4-acetoxy-3,5-bis(acetoxymethyl)phenyl]-2-(benzyloxycarbonylamino)propanoate CAS Name: (2S)-3-[4-acetyloxy-3,5-bis(acetyloxymethyl)phenyl]-2-(phenylmethoxycarbonylamino)propanoic acid methyl ester IUPAC Name: methyl (2S)-3-[4-acetyloxy-3,5-bis(acetyloxymethyl)phenyl]-2-(phenylmethoxycarbonylamino)propanoate Traditional Name: (2S)-3-[4-acetoxy-3,5-bis(acetoxymethyl)phenyl]-2-(benzyloxycarbonylamino)propionic acid methyl ester Formula: C26H29NO10 MolecularWeight: 515.50916

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1=CC(=CC(=C1OC(=O)C)COC(=O)C)CC(C(=O)OC)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(=O)OCC1=CC(=CC(=C1OC(=O)C)COC(=O)C)C[C@@H](C(=O)OC)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C26H29NO10/c1-16(28)34-14-21-10-20(11-22(15-35-17(2)29)24(21)37-18(3)30)12-23(25(31)33-4)27-26(32)36-13-19-8-6-5-7-9-19/h5-11,23H,12-15H2,1-4H3,(H,27,32)/t23-/m0/s1