chloranium 2-dimethylaminoethyl 5-methoxypyrimidin-1-ium-2-carboxylate

Systemtic Name: chloranium 2-dimethylaminoethyl 5-methoxypyrimidin-1-ium-2-carboxylate Openeye Name: chloronium 2-dimethylaminoethyl 5-methoxypyrimidin-1-ium-2-carboxylate CAS Name: chloronium 5-methoxy-2-pyrimidin-1-iumcarboxylic acid 2-dimethylaminoethyl ester IUPAC Name: chloranium 2-dimethylaminoethyl 5-methoxypyrimidin-1-ium-2-carboxylate Traditional Name: chloronium 5-methoxypyrimidin-1-ium-2-carboxylic acid 2-dimethylaminoethyl ester Formula: C10H18ClN3O3+2 MolecularWeight: 263.72122

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCOC(=O)C1=NC=C(C=[NH+]1)OC.[ClH2+]

Isomeric SMILES

CN(C)CCOC(=O)C1=NC=C(C=[NH+]1)OC.[ClH2+]

InChI

InChI=1S/C10H15N3O3.ClH2/c1-13(2)4-5-16-10(14)9-11-6-8(15-3)7-12-9;/h6-7H,4-5H2,1-3H3;1H2/q;+1/p+1