ethanedioic acid; 1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-pyrrolidin-1-yl-ethanone

Systemtic Name: ethanedioic acid; 1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-pyrrolidin-1-yl-ethanone Openeye Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-pyrrolidin-1-yl-ethanone; oxalic acid CAS Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-(1-pyrrolidinyl)ethanone; oxalic acid IUPAC Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-pyrrolidin-1-ylethanone; oxalic acid Traditional Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-pyrrolidino-ethanone; oxalic acid Formula: C16H22N2O6 MolecularWeight: 338.35568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C(=O)CN2CCCC2.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C(=O)CN2CCCC2.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H20N2O2.C2H2O4/c1-9-13(11(3)17)10(2)15-14(9)12(18)8-16-6-4-5-7-16;3-1(4)2(5)6/h15H,4-8H2,1-3H3;(H,3,4)(H,5,6)