ethanedioic acid; 3-methyl-1-(4-pyrrolidin-1-ylpiperidin-1-yl)butan-1-one

Systemtic Name: ethanedioic acid; 3-methyl-1-(4-pyrrolidin-1-ylpiperidin-1-yl)butan-1-one Openeye Name: 3-methyl-1-(4-pyrrolidin-1-yl-1-piperidyl)butan-1-one; oxalic acid CAS Name: 3-methyl-1-[4-(1-pyrrolidinyl)-1-piperidinyl]-1-butanone; oxalic acid IUPAC Name: 3-methyl-1-(4-pyrrolidin-1-ylpiperidin-1-yl)butan-1-one; oxalic acid Traditional Name: 3-methyl-1-(4-pyrrolidinopiperidino)butan-1-one; oxalic acid Formula: C16H28N2O5 MolecularWeight: 328.40392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1CCC(CC1)N2CCCC2.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)CC(=O)N1CCC(CC1)N2CCCC2.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H26N2O.C2H2O4/c1-12(2)11-14(17)16-9-5-13(6-10-16)15-7-3-4-8-15;3-1(4)2(5)6/h12-13H,3-11H2,1-2H3;(H,3,4)(H,5,6)