1-(1,3-benzodioxol-5-yl)-2-(4-methylpiperidin-1-yl)ethanone; ethanedioic acid

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-2-(4-methylpiperidin-1-yl)ethanone; ethanedioic acid Openeye Name: 1-(1,3-benzodioxol-5-yl)-2-(4-methyl-1-piperidyl)ethanone; oxalic acid CAS Name: 1-(1,3-benzodioxol-5-yl)-2-(4-methyl-1-piperidinyl)ethanone; oxalic acid IUPAC Name: 1-(1,3-benzodioxol-5-yl)-2-(4-methylpiperidin-1-yl)ethanone; oxalic acid Traditional Name: 1-(1,3-benzodioxol-5-yl)-2-(4-methylpiperidino)ethanone; oxalic acid Formula: C17H21NO7 MolecularWeight: 351.35114

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)CC(=O)C2=CC3=C(C=C2)OCO3.C(=O)(C(=O)O)O

Isomeric SMILES

CC1CCN(CC1)CC(=O)C2=CC3=C(C=C2)OCO3.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H19NO3.C2H2O4/c1-11-4-6-16(7-5-11)9-13(17)12-2-3-14-15(8-12)19-10-18-14;3-1(4)2(5)6/h2-3,8,11H,4-7,9-10H2,1H3;(H,3,4)(H,5,6)