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

Systemtic Name: [(4R)-5-ethoxycarbonyl-2-oxidanylidene-4-phenyl-3,4-dihydro-1H-pyrimidin-6-yl]methyl-pentan-3-yl-azanium Openeye Name: [(4R)-5-ethoxycarbonyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidin-6-yl]methyl-(1-ethylpropyl)ammonium CAS Name: [(4R)-5-ethoxycarbonyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidin-6-yl]methyl-pentan-3-ylammonium IUPAC Name: [(4R)-5-ethoxycarbonyl-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidin-6-yl]methyl-pentan-3-ylazanium Traditional Name: [(4R)-5-carbethoxy-2-keto-4-phenyl-3,4-dihydro-1H-pyrimidin-6-yl]methyl-(1-ethylpropyl)ammonium Formula: C19H28N3O3+ MolecularWeight: 346.44392

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)[NH2+]CC1=C(C(NC(=O)N1)C2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCC(CC)[NH2+]CC1=C([C@H](NC(=O)N1)C2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C19H27N3O3/c1-4-14(5-2)20-12-15-16(18(23)25-6-3)17(22-19(24)21-15)13-10-8-7-9-11-13/h7-11,14,17,20H,4-6,12H2,1-3H3,(H2,21,22,24)/p+1/t17-/m1/s1