6-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-1,3-dimethyl-pyrimidine-2,4-dione

Systemtic Name: 6-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-1,3-dimethyl-pyrimidine-2,4-dione Openeye Name: 6-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-1,3-dimethyl-pyrimidine-2,4-dione CAS Name: 6-[[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]methyl]-1,3-dimethylpyrimidine-2,4-dione IUPAC Name: 6-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-1,3-dimethylpyrimidine-2,4-dione Traditional Name: 6-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-1,3-dimethyl-pyrimidine-2,4-quinone Formula: C18H25N4O3+ MolecularWeight: 345.4161

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)N(C1=O)C)C[NH+]2CCN(CC2)C3=CC=CC=C3OC

Isomeric SMILES

CN1C(=CC(=O)N(C1=O)C)C[NH+]2CCN(CC2)C3=CC=CC=C3OC

InChI

InChI=1S/C18H24N4O3/c1-19-14(12-17(23)20(2)18(19)24)13-21-8-10-22(11-9-21)15-6-4-5-7-16(15)25-3/h4-7,12H,8-11,13H2,1-3H3/p+1