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

Systemtic Name: (3-azanylidene-1-oxidanidyl-1,2,4-benzotriazin-1-ium-4-yl) 2-chloranylethanoate Openeye Name: (3-imino-1-oxido-1,2,4-benzotriazin-1-ium-4-yl) 2-chloroacetate CAS Name: 2-chloroacetic 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) 2-chloroacetate Traditional Name: 2-chloroacetic acid (3-imino-1-oxido-1,2,4-benzotriazin-1-ium-4-yl) ester Formula: C9H7ClN4O3 MolecularWeight: 254.62988

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H7ClN4O3/c10-5-8(15)17-13-6-3-1-2-4-7(6)14(16)12-9(13)11/h1-4,11H,5H2