[2-(dimethylamino)-2-oxidanylidene-ethyl]-[[(4S)-5-ethoxycarbonyl-2-oxidanylidene-4-phenyl-3,4-dihydro-1H-pyrimidin-6-yl]methyl]-methyl-azanium

Systemtic Name: [2-(dimethylamino)-2-oxidanylidene-ethyl]-[[(4S)-5-ethoxycarbonyl-2-oxidanylidene-4-phenyl-3,4-dihydro-1H-pyrimidin-6-yl]methyl]-methyl-azanium Openeye Name: [2-(dimethylamino)-2-oxo-ethyl]-[[(4S)-5-ethoxycarbonyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidin-6-yl]methyl]-methyl-ammonium CAS Name: [2-(dimethylamino)-2-oxoethyl]-[[(4S)-5-ethoxycarbonyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidin-6-yl]methyl]-methylammonium IUPAC Name: [2-(dimethylamino)-2-oxoethyl]-[[(4S)-5-ethoxycarbonyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidin-6-yl]methyl]-methylazanium Traditional Name: [(4S)-5-carbethoxy-2-keto-4-phenyl-3,4-dihydro-1H-pyrimidin-6-yl]methyl-[2-(dimethylamino)-2-keto-ethyl]-methyl-ammonium Formula: C19H27N4O4+ MolecularWeight: 375.44208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26N4O4/c1-5-27-18(25)16-14(11-23(4)12-15(24)22(2)3)20-19(26)21-17(16)13-9-7-6-8-10-13/h6-10,17H,5,11-12H2,1-4H3,(H2,20,21,26)/p+1/t17-/m0/s1