methyl-[[3-(4-oxidanylidene-6-propan-2-yl-1H-pyrimidin-2-yl)phenyl]methyl]-[(2R)-2-oxidanyl-2-phenyl-ethyl]azanium

Systemtic Name: methyl-[[3-(4-oxidanylidene-6-propan-2-yl-1H-pyrimidin-2-yl)phenyl]methyl]-[(2R)-2-oxidanyl-2-phenyl-ethyl]azanium Openeye Name: [(2R)-2-hydroxy-2-phenyl-ethyl]-[[3-(6-isopropyl-4-oxo-1H-pyrimidin-2-yl)phenyl]methyl]-methyl-ammonium CAS Name: [(2R)-2-hydroxy-2-phenylethyl]-methyl-[[3-(4-oxo-6-propan-2-yl-1H-pyrimidin-2-yl)phenyl]methyl]ammonium IUPAC Name: [(2R)-2-hydroxy-2-phenylethyl]-methyl-[[3-(4-oxo-6-propan-2-yl-1H-pyrimidin-2-yl)phenyl]methyl]azanium Traditional Name: [(2R)-2-hydroxy-2-phenyl-ethyl]-[3-(6-isopropyl-4-keto-1H-pyrimidin-2-yl)benzyl]-methyl-ammonium Formula: C23H28N3O2+ MolecularWeight: 378.48732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=O)N=C(N1)C2=CC(=CC=C2)C[NH+](C)CC(C3=CC=CC=C3)O

Isomeric SMILES

CC(C)C1=CC(=O)N=C(N1)C2=CC(=CC=C2)C[NH+](C)C[C@@H](C3=CC=CC=C3)O

InChI

InChI=1S/C23H27N3O2/c1-16(2)20-13-22(28)25-23(24-20)19-11-7-8-17(12-19)14-26(3)15-21(27)18-9-5-4-6-10-18/h4-13,16,21,27H,14-15H2,1-3H3,(H,24,25,28)/p+1/t21-/m0/s1