[(4R)-4-(2,5-dimethylphenyl)-5-ethoxycarbonyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-6-yl]methyl-(2-methoxyethyl)azanium

Systemtic Name: [(4R)-4-(2,5-dimethylphenyl)-5-ethoxycarbonyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-6-yl]methyl-(2-methoxyethyl)azanium Openeye Name: [(4R)-4-(2,5-dimethylphenyl)-5-ethoxycarbonyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl]methyl-(2-methoxyethyl)ammonium CAS Name: [(4R)-4-(2,5-dimethylphenyl)-5-ethoxycarbonyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl]methyl-(2-methoxyethyl)ammonium IUPAC Name: [(4R)-4-(2,5-dimethylphenyl)-5-ethoxycarbonyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl]methyl-(2-methoxyethyl)azanium Traditional Name: [(4R)-5-carbethoxy-4-(2,5-dimethylphenyl)-2-keto-3,4-dihydro-1H-pyrimidin-6-yl]methyl-(2-methoxyethyl)ammonium Formula: C19H28N3O4+ MolecularWeight: 362.44332

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=C(C=CC(=C2)C)C)C[NH2+]CCOC

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N[C@@H]1C2=C(C=CC(=C2)C)C)C[NH2+]CCOC

InChI

InChI=1S/C19H27N3O4/c1-5-26-18(23)16-15(11-20-8-9-25-4)21-19(24)22-17(16)14-10-12(2)6-7-13(14)3/h6-7,10,17,20H,5,8-9,11H2,1-4H3,(H2,21,22,24)/p+1/t17-/m1/s1