[(1R)-1-(1,3-benzodioxol-5-yl)-2-(4,6-dimethyl-2-oxidanylidene-pyrimidin-1-yl)ethyl]azanium

Systemtic Name: [(1R)-1-(1,3-benzodioxol-5-yl)-2-(4,6-dimethyl-2-oxidanylidene-pyrimidin-1-yl)ethyl]azanium Openeye Name: [(1R)-1-(1,3-benzodioxol-5-yl)-2-(4,6-dimethyl-2-oxo-pyrimidin-1-yl)ethyl]ammonium CAS Name: [(1R)-1-(1,3-benzodioxol-5-yl)-2-(4,6-dimethyl-2-oxo-1-pyrimidinyl)ethyl]ammonium IUPAC Name: [(1R)-1-(1,3-benzodioxol-5-yl)-2-(4,6-dimethyl-2-oxopyrimidin-1-yl)ethyl]azanium Traditional Name: [(1R)-1-(1,3-benzodioxol-5-yl)-2-(2-keto-4,6-dimethyl-pyrimidin-1-yl)ethyl]ammonium Formula: C15H18N3O3+ MolecularWeight: 288.32172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=O)N1CC(C2=CC3=C(C=C2)OCO3)[NH3+])C

Isomeric SMILES

CC1=CC(=NC(=O)N1C[C@@H](C2=CC3=C(C=C2)OCO3)[NH3+])C

InChI

InChI=1S/C15H17N3O3/c1-9-5-10(2)18(15(19)17-9)7-12(16)11-3-4-13-14(6-11)21-8-20-13/h3-6,12H,7-8,16H2,1-2H3/p+1/t12-/m0/s1