methyl 2-acetamido-3-(1,3-benzodioxol-5-yl)-3-oxidanylidene-propanoate

Systemtic Name: methyl 2-acetamido-3-(1,3-benzodioxol-5-yl)-3-oxidanylidene-propanoate Openeye Name: methyl 2-acetamido-3-(1,3-benzodioxol-5-yl)-3-oxo-propanoate CAS Name: 2-acetamido-3-(1,3-benzodioxol-5-yl)-3-oxopropanoic acid methyl ester IUPAC Name: methyl 2-acetamido-3-(1,3-benzodioxol-5-yl)-3-oxopropanoate Traditional Name: 2-acetamido-3-(1,3-benzodioxol-5-yl)-3-keto-propionic acid methyl ester Formula: C13H13NO6 MolecularWeight: 279.24542

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(C(=O)C1=CC2=C(C=C1)OCO2)C(=O)OC

Isomeric SMILES

CC(=O)NC(C(=O)C1=CC2=C(C=C1)OCO2)C(=O)OC

InChI

InChI=1S/C13H13NO6/c1-7(15)14-11(13(17)18-2)12(16)8-3-4-9-10(5-8)20-6-19-9/h3-5,11H,6H2,1-2H3,(H,14,15)