3-[2-(4-iodophenyl)-2-oxidanylidene-ethyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[2-(4-iodophenyl)-2-oxidanylidene-ethyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[2-(4-iodophenyl)-2-oxo-ethyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[2-(4-iodophenyl)-2-oxoethyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[2-(4-iodophenyl)-2-oxoethyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[2-(4-iodophenyl)-2-keto-ethyl]-1,2,3-benzotriazin-4-one Formula: C15H10IN3O2 MolecularWeight: 391.16327

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H10IN3O2/c16-11-7-5-10(6-8-11)14(20)9-19-15(21)12-3-1-2-4-13(12)17-18-19/h1-8H,9H2