1-[1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]-4-methyl-N-(4-nitrophenyl)piperazin-1-ium-1-carboxamide

Systemtic Name: 1-[1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]-4-methyl-N-(4-nitrophenyl)piperazin-1-ium-1-carboxamide Openeye Name: 1-(1,3-dimethyl-2,6-dioxo-pyrimidin-4-yl)-4-methyl-N-(4-nitrophenyl)piperazin-1-ium-1-carboxamide CAS Name: 1-(1,3-dimethyl-2,6-dioxo-4-pyrimidinyl)-4-methyl-N-(4-nitrophenyl)-1-piperazin-1-iumcarboxamide IUPAC Name: 1-(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)-4-methyl-N-(4-nitrophenyl)piperazin-1-ium-1-carboxamide Traditional Name: 1-(2,6-diketo-1,3-dimethyl-pyrimidin-4-yl)-4-methyl-N-(4-nitrophenyl)piperazin-1-ium-1-carboxamide Formula: C18H23N6O5+ MolecularWeight: 403.41242

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC[N+](CC1)(C2=CC(=O)N(C(=O)N2C)C)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN1CC[N+](CC1)(C2=CC(=O)N(C(=O)N2C)C)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H22N6O5/c1-20-8-10-24(11-9-20,15-12-16(25)22(3)18(27)21(15)2)17(26)19-13-4-6-14(7-5-13)23(28)29/h4-7,12H,8-11H2,1-3H3/p+1