2-(chloromethyl)-4-methyl-3-oxidanidyl-quinazolin-3-ium-6-carbonitrile

Systemtic Name: 2-(chloromethyl)-4-methyl-3-oxidanidyl-quinazolin-3-ium-6-carbonitrile Openeye Name: 2-(chloromethyl)-4-methyl-3-oxido-quinazolin-3-ium-6-carbonitrile CAS Name: 2-(chloromethyl)-4-methyl-3-oxido-6-quinazolin-3-iumcarbonitrile IUPAC Name: 2-(chloromethyl)-4-methyl-3-oxidoquinazolin-3-ium-6-carbonitrile Traditional Name: 2-(chloromethyl)-4-methyl-3-oxido-quinazolin-3-ium-6-carbonitrile Formula: C11H8ClN3O MolecularWeight: 233.65372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C(=NC2=C1C=C(C=C2)C#N)CCl)[O-]

Isomeric SMILES

CC1=[N+](C(=NC2=C1C=C(C=C2)C#N)CCl)[O-]

InChI

InChI=1S/C11H8ClN3O/c1-7-9-4-8(6-13)2-3-10(9)14-11(5-12)15(7)16/h2-4H,5H2,1H3