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

Systemtic Name: (4-chlorophenyl)methyl-[[(4R)-5-ethoxycarbonyl-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-6-yl]methyl]-methyl-azanium Openeye Name: (4-chlorophenyl)methyl-[[(4R)-5-ethoxycarbonyl-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl]methyl]-methyl-ammonium CAS Name: (4-chlorophenyl)methyl-[[(4R)-5-ethoxycarbonyl-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl]methyl]-methylammonium IUPAC Name: (4-chlorophenyl)methyl-[[(4R)-5-ethoxycarbonyl-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl]methyl]-methylazanium Traditional Name: [(4R)-5-carbethoxy-2-keto-4-methyl-3,4-dihydro-1H-pyrimidin-6-yl]methyl-(4-chlorobenzyl)-methyl-ammonium Formula: C17H23ClN3O3+ MolecularWeight: 352.83582

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C)C[NH+](C)CC2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N[C@@H]1C)C[NH+](C)CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H22ClN3O3/c1-4-24-16(22)15-11(2)19-17(23)20-14(15)10-21(3)9-12-5-7-13(18)8-6-12/h5-8,11H,4,9-10H2,1-3H3,(H2,19,20,23)/p+1/t11-/m1/s1