[1-(1,3-benzodioxol-5-ylmethylamino)-1-oxidanylidene-propan-2-yl] 2-methylbutanoate

Systemtic Name: [1-(1,3-benzodioxol-5-ylmethylamino)-1-oxidanylidene-propan-2-yl] 2-methylbutanoate Openeye Name: [2-(1,3-benzodioxol-5-ylmethylamino)-1-methyl-2-oxo-ethyl] 2-methylbutanoate CAS Name: 2-methylbutanoic acid [1-(1,3-benzodioxol-5-ylmethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(1,3-benzodioxol-5-ylmethylamino)-1-oxopropan-2-yl] 2-methylbutanoate Traditional Name: 2-methylbutyric acid [2-keto-1-methyl-2-(piperonylamino)ethyl] ester Formula: C16H21NO5 MolecularWeight: 307.34164

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)OC(C)C(=O)NCC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCC(C)C(=O)OC(C)C(=O)NCC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C16H21NO5/c1-4-10(2)16(19)22-11(3)15(18)17-8-12-5-6-13-14(7-12)21-9-20-13/h5-7,10-11H,4,8-9H2,1-3H3,(H,17,18)