(3-azanylidene-1-oxidanidyl-1,2,4-benzotriazin-1-ium-4-yl) 4-chloranylbenzoate

Systemtic Name: (3-azanylidene-1-oxidanidyl-1,2,4-benzotriazin-1-ium-4-yl) 4-chloranylbenzoate Openeye Name: (3-imino-1-oxido-1,2,4-benzotriazin-1-ium-4-yl) 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid (3-imino-1-oxido-1,2,4-benzotriazin-1-ium-4-yl) ester IUPAC Name: (3-imino-1-oxido-1,2,4-benzotriazin-1-ium-4-yl) 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid (3-imino-1-oxido-1,2,4-benzotriazin-1-ium-4-yl) ester Formula: C14H9ClN4O3 MolecularWeight: 316.69926

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C(=N)N=[N+]2[O-])OC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N(C(=N)N=[N+]2[O-])OC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C14H9ClN4O3/c15-10-7-5-9(6-8-10)13(20)22-18-11-3-1-2-4-12(11)19(21)17-14(18)16/h1-8,16H