(phenylmethyl) N-[2-acetamido-3,4,6-tris(oxidanyl)-5-oxidanylidene-hexyl]carbamate

Systemtic Name: (phenylmethyl) N-[2-acetamido-3,4,6-tris(oxidanyl)-5-oxidanylidene-hexyl]carbamate Openeye Name: benzyl N-(2-acetamido-3,4,6-trihydroxy-5-oxo-hexyl)carbamate CAS Name: N-(2-acetamido-3,4,6-trihydroxy-5-oxohexyl)carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-(2-acetamido-3,4,6-trihydroxy-5-oxohexyl)carbamate Traditional Name: N-(2-acetamido-3,4,6-trihydroxy-5-keto-hexyl)carbamic acid benzyl ester Formula: C16H22N2O7 MolecularWeight: 354.35508

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CNC(=O)OCC1=CC=CC=C1)C(C(C(=O)CO)O)O

Isomeric SMILES

CC(=O)NC(CNC(=O)OCC1=CC=CC=C1)C(C(C(=O)CO)O)O

InChI

InChI=1S/C16H22N2O7/c1-10(20)18-12(14(22)15(23)13(21)8-19)7-17-16(24)25-9-11-5-3-2-4-6-11/h2-6,12,14-15,19,22-23H,7-9H2,1H3,(H,17,24)(H,18,20)