[(1S)-2-(4,6-dimethyl-2-oxidanylidene-pyrimidin-1-yl)-1-(4-propan-2-ylphenyl)ethyl]azanium

Systemtic Name: [(1S)-2-(4,6-dimethyl-2-oxidanylidene-pyrimidin-1-yl)-1-(4-propan-2-ylphenyl)ethyl]azanium Openeye Name: [(1S)-2-(4,6-dimethyl-2-oxo-pyrimidin-1-yl)-1-(4-isopropylphenyl)ethyl]ammonium CAS Name: [(1S)-2-(4,6-dimethyl-2-oxo-1-pyrimidinyl)-1-(4-propan-2-ylphenyl)ethyl]ammonium IUPAC Name: [(1S)-2-(4,6-dimethyl-2-oxopyrimidin-1-yl)-1-(4-propan-2-ylphenyl)ethyl]azanium Traditional Name: [(1S)-2-(2-keto-4,6-dimethyl-pyrimidin-1-yl)-1-p-cumenyl-ethyl]ammonium Formula: C17H24N3O+ MolecularWeight: 286.39196

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23N3O/c1-11(2)14-5-7-15(8-6-14)16(18)10-20-13(4)9-12(3)19-17(20)21/h5-9,11,16H,10,18H2,1-4H3/p+1/t16-/m1/s1