benzotriazol-1-yl-(3-iodanyl-4-methoxy-phenyl)methanone

Systemtic Name: benzotriazol-1-yl-(3-iodanyl-4-methoxy-phenyl)methanone Openeye Name: benzotriazol-1-yl-(3-iodo-4-methoxy-phenyl)methanone CAS Name: 1-benzotriazolyl-(3-iodo-4-methoxyphenyl)methanone IUPAC Name: benzotriazol-1-yl-(3-iodo-4-methoxyphenyl)methanone Traditional Name: benzotriazol-1-yl-(3-iodo-4-methoxy-phenyl)methanone Formula: C14H10IN3O2 MolecularWeight: 379.15257

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2C3=CC=CC=C3N=N2)I

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2C3=CC=CC=C3N=N2)I

InChI

InChI=1S/C14H10IN3O2/c1-20-13-7-6-9(8-10(13)15)14(19)18-12-5-3-2-4-11(12)16-17-18/h2-8H,1H3