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

Systemtic Name: (5-ethoxycarbonyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-6-yl)methyl-[(4-ethoxy-3-methoxy-phenyl)methyl]-methyl-azanium Openeye Name: (5-ethoxycarbonyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl)methyl-[(4-ethoxy-3-methoxy-phenyl)methyl]-methyl-ammonium CAS Name: (5-ethoxycarbonyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl)methyl-[(4-ethoxy-3-methoxyphenyl)methyl]-methylammonium IUPAC Name: (5-ethoxycarbonyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl)methyl-[(4-ethoxy-3-methoxyphenyl)methyl]-methylazanium Traditional Name: (5-carbethoxy-2-keto-3,4-dihydro-1H-pyrimidin-6-yl)methyl-(4-ethoxy-3-methoxy-benzyl)-methyl-ammonium Formula: C19H28N3O5+ MolecularWeight: 378.44272

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C[NH+](C)CC2=C(CNC(=O)N2)C(=O)OCC)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C[NH+](C)CC2=C(CNC(=O)N2)C(=O)OCC)OC

InChI

InChI=1S/C19H27N3O5/c1-5-26-16-8-7-13(9-17(16)25-4)11-22(3)12-15-14(18(23)27-6-2)10-20-19(24)21-15/h7-9H,5-6,10-12H2,1-4H3,(H2,20,21,24)/p+1