O7-ethyl O1-(phenylmethyl) (2S)-5-oxidanylidene-2-(phenylmethoxycarbonylamino)heptanedioate

Systemtic Name: O7-ethyl O1-(phenylmethyl) (2S)-5-oxidanylidene-2-(phenylmethoxycarbonylamino)heptanedioate Openeye Name: O1-benzyl O7-ethyl (2S)-2-(benzyloxycarbonylamino)-5-oxo-heptanedioate CAS Name: (2S)-5-oxo-2-(phenylmethoxycarbonylamino)heptanedioic acid O7-ethyl ester O1-(phenylmethyl) ester IUPAC Name: 1-O-benzyl 7-O-ethyl (2S)-5-oxo-2-(phenylmethoxycarbonylamino)heptanedioate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-5-keto-pimelic acid O1-benzyl ester O7-ethyl ester Formula: C24H27NO7 MolecularWeight: 441.47368

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)CCC(C(=O)OCC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C24H27NO7/c1-2-30-22(27)15-20(26)13-14-21(23(28)31-16-18-9-5-3-6-10-18)25-24(29)32-17-19-11-7-4-8-12-19/h3-12,21H,2,13-17H2,1H3,(H,25,29)/t21-/m0/s1