[2-(benzotriazol-2-yl)-4-methyl-phenyl] 2-iodanylbenzoate

Systemtic Name: [2-(benzotriazol-2-yl)-4-methyl-phenyl] 2-iodanylbenzoate Openeye Name: [2-(benzotriazol-2-yl)-4-methyl-phenyl] 2-iodobenzoate CAS Name: 2-iodobenzoic acid [2-(2-benzotriazolyl)-4-methylphenyl] ester IUPAC Name: [2-(benzotriazol-2-yl)-4-methylphenyl] 2-iodobenzoate Traditional Name: 2-iodobenzoic acid [2-(benzotriazol-2-yl)-4-methyl-phenyl] ester Formula: C20H14IN3O2 MolecularWeight: 455.24853

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(=O)C2=CC=CC=C2I)N3N=C4C=CC=CC4=N3

Isomeric SMILES

CC1=CC(=C(C=C1)OC(=O)C2=CC=CC=C2I)N3N=C4C=CC=CC4=N3

InChI

InChI=1S/C20H14IN3O2/c1-13-10-11-19(26-20(25)14-6-2-3-7-15(14)21)18(12-13)24-22-16-8-4-5-9-17(16)23-24/h2-12H,1H3