ethanedioic acid; N-(6-ethanoyl-1,3-benzodioxol-5-yl)-2-(4-piperidin-1-ylpiperidin-1-yl)ethanamide

Systemtic Name: ethanedioic acid; N-(6-ethanoyl-1,3-benzodioxol-5-yl)-2-(4-piperidin-1-ylpiperidin-1-yl)ethanamide Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[4-(1-piperidyl)-1-piperidyl]acetamide; oxalic acid CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[4-(1-piperidinyl)-1-piperidinyl]acetamide; oxalic acid IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(4-piperidin-1-ylpiperidin-1-yl)acetamide; oxalic acid Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(4-piperidinopiperidino)acetamide; oxalic acid Formula: C23H31N3O8 MolecularWeight: 477.50754

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=O)CN3CCC(CC3)N4CCCCC4)OCO2.C(=O)(C(=O)O)O

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)CN3CCC(CC3)N4CCCCC4)OCO2.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H29N3O4.C2H2O4/c1-15(25)17-11-19-20(28-14-27-19)12-18(17)22-21(26)13-23-9-5-16(6-10-23)24-7-3-2-4-8-24;3-1(4)2(5)6/h11-12,16H,2-10,13-14H2,1H3,(H,22,26);(H,3,4)(H,5,6)