(2S,3R)-4-azanyl-4-oxidanylidene-2-(phenylmethoxycarbonylamino)-3-(phenylmethoxymethoxymethyl)butanoic acid

Systemtic Name: (2S,3R)-4-azanyl-4-oxidanylidene-2-(phenylmethoxycarbonylamino)-3-(phenylmethoxymethoxymethyl)butanoic acid Openeye Name: (2S,3R)-4-amino-2-(benzyloxycarbonylamino)-3-(benzyloxymethoxymethyl)-4-oxo-butanoic acid CAS Name: (2S,3R)-4-amino-4-oxo-2-(phenylmethoxycarbonylamino)-3-(phenylmethoxymethoxymethyl)butanoic acid IUPAC Name: (2S,3R)-4-amino-4-oxo-2-(phenylmethoxycarbonylamino)-3-(phenylmethoxymethoxymethyl)butanoic acid Traditional Name: (2S,3R)-4-amino-3-(benzoxymethoxymethyl)-2-(benzyloxycarbonylamino)-4-keto-butyric acid Formula: C21H24N2O7 MolecularWeight: 416.42446

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCOCC(C(C(=O)O)NC(=O)OCC2=CC=CC=C2)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)COCOC[C@@H]([C@@H](C(=O)O)NC(=O)OCC2=CC=CC=C2)C(=O)N

InChI

InChI=1S/C21H24N2O7/c22-19(24)17(13-29-14-28-11-15-7-3-1-4-8-15)18(20(25)26)23-21(27)30-12-16-9-5-2-6-10-16/h1-10,17-18H,11-14H2,(H2,22,24)(H,23,27)(H,25,26)/t17-,18-/m0/s1