7-chloranyl-3-methyl-4aH-1,2,3-benzotriazin-3-ium-4-one

Systemtic Name: 7-chloranyl-3-methyl-4aH-1,2,3-benzotriazin-3-ium-4-one Openeye Name: 7-chloro-3-methyl-4aH-1,2,3-benzotriazin-3-ium-4-one CAS Name: 7-chloro-3-methyl-4aH-1,2,3-benzotriazin-3-ium-4-one IUPAC Name: 7-chloro-3-methyl-4aH-1,2,3-benzotriazin-3-ium-4-one Traditional Name: 7-chloro-3-methyl-4aH-1,2,3-benzotriazin-3-ium-4-one Formula: C8H7ClN3O+ MolecularWeight: 196.61368

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=NN=C2C=C(C=CC2C1=O)Cl

Isomeric SMILES

C[N+]1=NN=C2C=C(C=CC2C1=O)Cl

InChI

InChI=1S/C8H7ClN3O/c1-12-8(13)6-3-2-5(9)4-7(6)10-11-12/h2-4,6H,1H3/q+1