[2-(benzotriazol-2-yl)-4-methyl-phenyl] 3-(phenylcarbamoyl)benzenesulfonate

Systemtic Name: [2-(benzotriazol-2-yl)-4-methyl-phenyl] 3-(phenylcarbamoyl)benzenesulfonate Openeye Name: [2-(benzotriazol-2-yl)-4-methyl-phenyl] 3-(phenylcarbamoyl)benzenesulfonate CAS Name: 3-[anilino(oxo)methyl]benzenesulfonic acid [2-(2-benzotriazolyl)-4-methylphenyl] ester IUPAC Name: [2-(benzotriazol-2-yl)-4-methylphenyl] 3-(phenylcarbamoyl)benzenesulfonate Traditional Name: 3-(phenylcarbamoyl)benzenesulfonic acid [2-(benzotriazol-2-yl)-4-methyl-phenyl] ester Formula: C26H20N4O4S MolecularWeight: 484.5264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OS(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC=CC=C3)N4N=C5C=CC=CC5=N4

Isomeric SMILES

CC1=CC(=C(C=C1)OS(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC=CC=C3)N4N=C5C=CC=CC5=N4

InChI

InChI=1S/C26H20N4O4S/c1-18-14-15-25(24(16-18)30-28-22-12-5-6-13-23(22)29-30)34-35(32,33)21-11-7-8-19(17-21)26(31)27-20-9-3-2-4-10-20/h2-17H,1H3,(H,27,31)