hydron; 1-piperidin-1-ylpropan-2-yl 1,3-benzodioxole-5-carboxylate; chloride

Systemtic Name: hydron; 1-piperidin-1-ylpropan-2-yl 1,3-benzodioxole-5-carboxylate; chloride Openeye Name: hydron; [1-methyl-2-(1-piperidyl)ethyl] 1,3-benzodioxole-5-carboxylate; chloride CAS Name: 1,3-benzodioxole-5-carboxylic acid 1-(1-piperidinyl)propan-2-yl ester; hydron; chloride IUPAC Name: hydron; 1-piperidin-1-ylpropan-2-yl 1,3-benzodioxole-5-carboxylate; chloride Traditional Name: hydron; piperonylic acid (1-methyl-2-piperidino-ethyl) ester; chloride Formula: C16H22ClNO4 MolecularWeight: 327.80318

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Descriptors Computed from Structure

Canonical SMILES:

[H+].CC(CN1CCCCC1)OC(=O)C2=CC3=C(C=C2)OCO3.[Cl-]

Isomeric SMILES

[H+].CC(CN1CCCCC1)OC(=O)C2=CC3=C(C=C2)OCO3.[Cl-]

InChI

InChI=1S/C16H21NO4.ClH/c1-12(10-17-7-3-2-4-8-17)21-16(18)13-5-6-14-15(9-13)20-11-19-14;/h5-6,9,12H,2-4,7-8,10-11H2,1H3;1H