3,6-dimethyl-1-(6-pyrrolidin-1-ylhexyl)pyrimidine-2,4-dione; ethanedioic acid

Systemtic Name: 3,6-dimethyl-1-(6-pyrrolidin-1-ylhexyl)pyrimidine-2,4-dione; ethanedioic acid Openeye Name: 3,6-dimethyl-1-(6-pyrrolidin-1-ylhexyl)pyrimidine-2,4-dione; oxalic acid CAS Name: 3,6-dimethyl-1-[6-(1-pyrrolidinyl)hexyl]pyrimidine-2,4-dione; oxalic acid IUPAC Name: 3,6-dimethyl-1-(6-pyrrolidin-1-ylhexyl)pyrimidine-2,4-dione; oxalic acid Traditional Name: 3,6-dimethyl-1-(6-pyrrolidinohexyl)pyrimidine-2,4-quinone; oxalic acid Formula: C18H29N3O6 MolecularWeight: 383.43936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C(=O)N1CCCCCCN2CCCC2)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=O)N(C(=O)N1CCCCCCN2CCCC2)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H27N3O2.C2H2O4/c1-14-13-15(20)17(2)16(21)19(14)12-6-4-3-5-9-18-10-7-8-11-18;3-1(4)2(5)6/h13H,3-12H2,1-2H3;(H,3,4)(H,5,6)