methyl 2-[(1S,2S)-1-acetamido-2-methoxycarbonyl-3-oxidanylidene-butyl]benzoate

Systemtic Name: methyl 2-[(1S,2S)-1-acetamido-2-methoxycarbonyl-3-oxidanylidene-butyl]benzoate Openeye Name: methyl 2-[(1S,2S)-1-acetamido-2-methoxycarbonyl-3-oxo-butyl]benzoate CAS Name: 2-[(1S,2S)-1-acetamido-2-methoxycarbonyl-3-oxobutyl]benzoic acid methyl ester IUPAC Name: methyl 2-[(1S,2S)-1-acetamido-2-methoxycarbonyl-3-oxobutyl]benzoate Traditional Name: 2-[(1S,2S)-1-acetamido-2-carbomethoxy-3-keto-butyl]benzoic acid methyl ester Formula: C16H19NO6 MolecularWeight: 321.32516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(C1=CC=CC=C1C(=O)OC)NC(=O)C)C(=O)OC

Isomeric SMILES

CC(=O)[C@H]([C@@H](C1=CC=CC=C1C(=O)OC)NC(=O)C)C(=O)OC

InChI

InChI=1S/C16H19NO6/c1-9(18)13(16(21)23-4)14(17-10(2)19)11-7-5-6-8-12(11)15(20)22-3/h5-8,13-14H,1-4H3,(H,17,19)/t13-,14-/m1/s1