[(6R)-5-ethoxycarbonyl-3-methyl-2-oxidanylidene-6-phenyl-1,6-dihydropyrimidin-4-yl]methyl-di(propan-2-yl)azanium

Systemtic Name: [(6R)-5-ethoxycarbonyl-3-methyl-2-oxidanylidene-6-phenyl-1,6-dihydropyrimidin-4-yl]methyl-di(propan-2-yl)azanium Openeye Name: [(6R)-5-ethoxycarbonyl-3-methyl-2-oxo-6-phenyl-1,6-dihydropyrimidin-4-yl]methyl-diisopropyl-ammonium CAS Name: [(6R)-5-ethoxycarbonyl-3-methyl-2-oxo-6-phenyl-1,6-dihydropyrimidin-4-yl]methyl-di(propan-2-yl)ammonium IUPAC Name: [(6R)-5-ethoxycarbonyl-3-methyl-2-oxo-6-phenyl-1,6-dihydropyrimidin-4-yl]methyl-di(propan-2-yl)azanium Traditional Name: [(6R)-5-carbethoxy-2-keto-3-methyl-6-phenyl-1,6-dihydropyrimidin-4-yl]methyl-diisopropyl-ammonium Formula: C21H32N3O3+ MolecularWeight: 374.49708

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H31N3O3/c1-7-27-20(25)18-17(13-24(14(2)3)15(4)5)23(6)21(26)22-19(18)16-11-9-8-10-12-16/h8-12,14-15,19H,7,13H2,1-6H3,(H,22,26)/p+1/t19-/m1/s1