ethyl 2,4-dimethyl-3-(phenylmethyl)-1,6-dihydropyrimidin-3-ium-5-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-3-(phenylmethyl)-1,6-dihydropyrimidin-3-ium-5-carboxylate Openeye Name: ethyl 3-benzyl-2,4-dimethyl-1,6-dihydropyrimidin-3-ium-5-carboxylate CAS Name: 2,4-dimethyl-3-(phenylmethyl)-1,6-dihydropyrimidin-3-ium-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-benzyl-2,4-dimethyl-1,6-dihydropyrimidin-3-ium-5-carboxylate Traditional Name: 3-benzyl-2,4-dimethyl-1,6-dihydropyrimidin-3-ium-5-carboxylic acid ethyl ester Formula: C16H21N2O2+ MolecularWeight: 273.35014

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C([N+](=C(NC1)C)CC2=CC=CC=C2)C

Isomeric SMILES

CCOC(=O)C1=C([N+](=C(NC1)C)CC2=CC=CC=C2)C

InChI

InChI=1S/C16H20N2O2/c1-4-20-16(19)15-10-17-13(3)18(12(15)2)11-14-8-6-5-7-9-14/h5-9H,4,10-11H2,1-3H3/p+1