1,3-dimethyl-6-[2-[[1-(4-nitrophenyl)piperidin-4-yl]amino]ethylamino]pyrimidine-2,4-dione; ethanedioic acid

Systemtic Name: 1,3-dimethyl-6-[2-[[1-(4-nitrophenyl)piperidin-4-yl]amino]ethylamino]pyrimidine-2,4-dione; ethanedioic acid Openeye Name: 1,3-dimethyl-6-[2-[[1-(4-nitrophenyl)-4-piperidyl]amino]ethylamino]pyrimidine-2,4-dione; oxalic acid CAS Name: 1,3-dimethyl-6-[2-[[1-(4-nitrophenyl)-4-piperidinyl]amino]ethylamino]pyrimidine-2,4-dione; oxalic acid IUPAC Name: 1,3-dimethyl-6-[2-[[1-(4-nitrophenyl)piperidin-4-yl]amino]ethylamino]pyrimidine-2,4-dione; oxalic acid Traditional Name: 1,3-dimethyl-6-[2-[[1-(4-nitrophenyl)-4-piperidyl]amino]ethylamino]pyrimidine-2,4-quinone; oxalic acid Formula: C21H28N6O8 MolecularWeight: 492.48242

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)N(C1=O)C)NCCNC2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-].C(=O)(C(=O)O)O

Isomeric SMILES

CN1C(=CC(=O)N(C1=O)C)NCCNC2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-].C(=O)(C(=O)O)O

InChI

InChI=1S/C19H26N6O4.C2H2O4/c1-22-17(13-18(26)23(2)19(22)27)21-10-9-20-14-7-11-24(12-8-14)15-3-5-16(6-4-15)25(28)29;3-1(4)2(5)6/h3-6,13-14,20-21H,7-12H2,1-2H3;(H,3,4)(H,5,6)