ethanedioic acid; 3-[3-(2-oxidanylidenepyrrolidin-1-yl)propylamino]-N-phenyl-butanamide

Systemtic Name: ethanedioic acid; 3-[3-(2-oxidanylidenepyrrolidin-1-yl)propylamino]-N-phenyl-butanamide Openeye Name: oxalic acid; 3-[3-(2-oxopyrrolidin-1-yl)propylamino]-N-phenyl-butanamide CAS Name: oxalic acid; 3-[3-(2-oxo-1-pyrrolidinyl)propylamino]-N-phenylbutanamide IUPAC Name: oxalic acid; 3-[3-(2-oxopyrrolidin-1-yl)propylamino]-N-phenylbutanamide Traditional Name: 3-[3-(2-ketopyrrolidino)propylamino]-N-phenyl-butyramide; oxalic acid Formula: C19H27N3O6 MolecularWeight: 393.43418

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=CC=CC=C1)NCCCN2CCCC2=O.C(=O)(C(=O)O)O

Isomeric SMILES

CC(CC(=O)NC1=CC=CC=C1)NCCCN2CCCC2=O.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H25N3O2.C2H2O4/c1-14(13-16(21)19-15-7-3-2-4-8-15)18-10-6-12-20-11-5-9-17(20)22;3-1(4)2(5)6/h2-4,7-8,14,18H,5-6,9-13H2,1H3,(H,19,21);(H,3,4)(H,5,6)