2-butyl-3-oxidanylidene-6-(2-oxidanylpropan-2-yl)quinazolin-3-ium-4-one

Systemtic Name: 2-butyl-3-oxidanylidene-6-(2-oxidanylpropan-2-yl)quinazolin-3-ium-4-one Openeye Name: 2-butyl-6-(1-hydroxy-1-methyl-ethyl)-3-oxo-quinazolin-3-ium-4-one CAS Name: 2-butyl-6-(2-hydroxypropan-2-yl)-3-oxo-4-quinazolin-3-iumone IUPAC Name: 2-butyl-6-(2-hydroxypropan-2-yl)-3-oxoquinazolin-3-ium-4-one Traditional Name: 2-butyl-6-(1-hydroxy-1-methyl-ethyl)-3-keto-quinazolin-3-ium-4-one Formula: C15H19N2O3+ MolecularWeight: 275.32296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(C=C(C=C2)C(C)(C)O)C(=O)[N+]1=O

Isomeric SMILES

CCCCC1=NC2=C(C=C(C=C2)C(C)(C)O)C(=O)[N+]1=O

InChI

InChI=1S/C15H19N2O3/c1-4-5-6-13-16-12-8-7-10(15(2,3)19)9-11(12)14(18)17(13)20/h7-9,19H,4-6H2,1-3H3/q+1