[2-acetyloxy-4-methylsulfonyloxy-1-oxidanylidene-1-[(phenylmethyl)amino]pentan-3-yl] ethanoate

Systemtic Name: [2-acetyloxy-4-methylsulfonyloxy-1-oxidanylidene-1-[(phenylmethyl)amino]pentan-3-yl] ethanoate Openeye Name: [2-acetoxy-3-(benzylamino)-1-(1-methylsulfonyloxyethyl)-3-oxo-propyl] acetate CAS Name: acetic acid [2-acetyloxy-4-methylsulfonyloxy-1-oxo-1-[(phenylmethyl)amino]pentan-3-yl] ester IUPAC Name: [2-acetyloxy-1-(benzylamino)-4-methylsulfonyloxy-1-oxopentan-3-yl] acetate Traditional Name: acetic acid [2-acetoxy-3-(benzylamino)-3-keto-1-(1-methylsulfonyloxyethyl)propyl] ester Formula: C17H23NO8S MolecularWeight: 401.43142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(C(=O)NCC1=CC=CC=C1)OC(=O)C)OC(=O)C)OS(=O)(=O)C

Isomeric SMILES

CC(C(C(C(=O)NCC1=CC=CC=C1)OC(=O)C)OC(=O)C)OS(=O)(=O)C

InChI

InChI=1S/C17H23NO8S/c1-11(26-27(4,22)23)15(24-12(2)19)16(25-13(3)20)17(21)18-10-14-8-6-5-7-9-14/h5-9,11,15-16H,10H2,1-4H3,(H,18,21)