2-methyl-3-prop-2-enyl-1H-quinazolin-3-ium-4-one chloride

Systemtic Name: 2-methyl-3-prop-2-enyl-1H-quinazolin-3-ium-4-one chloride Openeye Name: 3-allyl-2-methyl-1H-quinazolin-3-ium-4-one chloride CAS Name: 2-methyl-3-prop-2-enyl-1H-quinazolin-3-ium-4-one chloride IUPAC Name: 2-methyl-3-prop-2-enyl-1H-quinazolin-3-ium-4-one chloride Traditional Name: 3-allyl-2-methyl-1H-quinazolin-3-ium-4-one chloride Formula: C12H13ClN2O MolecularWeight: 236.69742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C(=O)C2=CC=CC=C2N1)CC=C.[Cl-]

Isomeric SMILES

CC1=[N+](C(=O)C2=CC=CC=C2N1)CC=C.[Cl-]

InChI

InChI=1S/C12H12N2O.ClH/c1-3-8-14-9(2)13-11-7-5-4-6-10(11)12(14)15;/h3-7H,1,8H2,2H3;1H