2-[(4-propylpyridin-1-ium-1-yl)methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[(4-propylpyridin-1-ium-1-yl)methyl]-1H-quinazolin-4-one Openeye Name: 2-[(4-propylpyridin-1-ium-1-yl)methyl]-1H-quinazolin-4-one CAS Name: 2-[(4-propyl-1-pyridin-1-iumyl)methyl]-1H-quinazolin-4-one IUPAC Name: 2-[(4-propylpyridin-1-ium-1-yl)methyl]-1H-quinazolin-4-one Traditional Name: 2-[(4-propylpyridin-1-ium-1-yl)methyl]-1H-quinazolin-4-one Formula: C17H18N3O+ MolecularWeight: 280.34432

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=[N+](C=C1)CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CCCC1=CC=[N+](C=C1)CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C17H17N3O/c1-2-5-13-8-10-20(11-9-13)12-16-18-15-7-4-3-6-14(15)17(21)19-16/h3-4,6-11H,2,5,12H2,1H3/p+1