(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 3-iodanylbenzoate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl 3-iodanylbenzoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 3-iodobenzoate CAS Name: 3-iodobenzoic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl 3-iodobenzoate Traditional Name: 3-iodobenzoic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C15H10IN3O3 MolecularWeight: 407.16267

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)C3=CC(=CC=C3)I

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(N=N2)COC(=O)C3=CC(=CC=C3)I

InChI

InChI=1S/C15H10IN3O3/c16-11-5-3-4-10(8-11)15(21)22-9-19-14(20)12-6-1-2-7-13(12)17-18-19/h1-8H,9H2