6-[[(2S)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]-1,3-dimethyl-pyrimidine-2,4-dione

Systemtic Name: 6-[[(2S)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]-1,3-dimethyl-pyrimidine-2,4-dione Openeye Name: 6-[[(2S)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]-1,3-dimethyl-pyrimidine-2,4-dione CAS Name: 6-[[(2S)-2-(2,5-dimethoxyphenyl)-1-pyrrolidin-1-iumyl]methyl]-1,3-dimethylpyrimidine-2,4-dione IUPAC Name: 6-[[(2S)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]-1,3-dimethylpyrimidine-2,4-dione Traditional Name: 6-[[(2S)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]-1,3-dimethyl-pyrimidine-2,4-quinone Formula: C19H26N3O4+ MolecularWeight: 360.42744

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)N(C1=O)C)C[NH+]2CCCC2C3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CN1C(=CC(=O)N(C1=O)C)C[NH+]2CCC[C@H]2C3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C19H25N3O4/c1-20-13(10-18(23)21(2)19(20)24)12-22-9-5-6-16(22)15-11-14(25-3)7-8-17(15)26-4/h7-8,10-11,16H,5-6,9,12H2,1-4H3/p+1/t16-/m0/s1