[4-(5-butyl-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)phenyl]methyl-methyl-(oxan-4-yl)azanium

Systemtic Name: [4-(5-butyl-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)phenyl]methyl-methyl-(oxan-4-yl)azanium Openeye Name: [4-(5-butyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)phenyl]methyl-methyl-tetrahydropyran-4-yl-ammonium CAS Name: [4-(5-butyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)phenyl]methyl-methyl-(4-oxanyl)ammonium IUPAC Name: [4-(5-butyl-6-methyl-4-oxo-1H-pyrimidin-2-yl)phenyl]methyl-methyl-(oxan-4-yl)azanium Traditional Name: [4-(5-butyl-4-keto-6-methyl-1H-pyrimidin-2-yl)benzyl]-methyl-tetrahydropyran-4-yl-ammonium Formula: C22H32N3O2+ MolecularWeight: 370.50838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(NC(=NC1=O)C2=CC=C(C=C2)C[NH+](C)C3CCOCC3)C

Isomeric SMILES

CCCCC1=C(NC(=NC1=O)C2=CC=C(C=C2)C[NH+](C)C3CCOCC3)C

InChI

InChI=1S/C22H31N3O2/c1-4-5-6-20-16(2)23-21(24-22(20)26)18-9-7-17(8-10-18)15-25(3)19-11-13-27-14-12-19/h7-10,19H,4-6,11-15H2,1-3H3,(H,23,24,26)/p+1