6-(4-chloranylphenoxy)-3-[(1-oxidanidylpyridin-1-ium-4-yl)methyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 6-(4-chloranylphenoxy)-3-[(1-oxidanidylpyridin-1-ium-4-yl)methyl]-1,2,3-benzotriazin-4-one Openeye Name: 6-(4-chlorophenoxy)-3-[(1-oxidopyridin-1-ium-4-yl)methyl]-1,2,3-benzotriazin-4-one CAS Name: 6-(4-chlorophenoxy)-3-[(1-oxido-4-pyridin-1-iumyl)methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 6-(4-chlorophenoxy)-3-[(1-oxidopyridin-1-ium-4-yl)methyl]-1,2,3-benzotriazin-4-one Traditional Name: 6-(4-chlorophenoxy)-3-[(1-oxidopyridin-1-ium-4-yl)methyl]-1,2,3-benzotriazin-4-one Formula: C19H13ClN4O3 MolecularWeight: 380.78452

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OC2=CC3=C(C=C2)N=NN(C3=O)CC4=CC=[N+](C=C4)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1OC2=CC3=C(C=C2)N=NN(C3=O)CC4=CC=[N+](C=C4)[O-])Cl

InChI

InChI=1S/C19H13ClN4O3/c20-14-1-3-15(4-2-14)27-16-5-6-18-17(11-16)19(25)24(22-21-18)12-13-7-9-23(26)10-8-13/h1-11H,12H2