[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl] (2R)-2-acetamido-3-methyl-butanoate

Systemtic Name: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl] (2R)-2-acetamido-3-methyl-butanoate Openeye Name: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxo-ethyl] (2R)-2-acetamido-3-methyl-butanoate CAS Name: (2R)-2-acetamido-3-methylbutanoic acid [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] ester IUPAC Name: [2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl] (2R)-2-acetamido-3-methylbutanoate Traditional Name: (2R)-2-acetamido-3-methyl-butyric acid [2-keto-2-(piperonylamino)ethyl] ester Formula: C17H22N2O6 MolecularWeight: 350.36638

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)NCC1=CC2=C(C=C1)OCO2)NC(=O)C

Isomeric SMILES

CC(C)[C@H](C(=O)OCC(=O)NCC1=CC2=C(C=C1)OCO2)NC(=O)C

InChI

InChI=1S/C17H22N2O6/c1-10(2)16(19-11(3)20)17(22)23-8-15(21)18-7-12-4-5-13-14(6-12)25-9-24-13/h4-6,10,16H,7-9H2,1-3H3,(H,18,21)(H,19,20)/t16-/m1/s1