[2-(benzotriazol-2-yl)-4-methyl-phenyl] 4-(4-chlorophenyl)sulfonylbenzoate

Systemtic Name: [2-(benzotriazol-2-yl)-4-methyl-phenyl] 4-(4-chlorophenyl)sulfonylbenzoate Openeye Name: [2-(benzotriazol-2-yl)-4-methyl-phenyl] 4-(4-chlorophenyl)sulfonylbenzoate CAS Name: 4-(4-chlorophenyl)sulfonylbenzoic acid [2-(2-benzotriazolyl)-4-methylphenyl] ester IUPAC Name: [2-(benzotriazol-2-yl)-4-methylphenyl] 4-(4-chlorophenyl)sulfonylbenzoate Traditional Name: 4-(4-chlorophenyl)sulfonylbenzoic acid [2-(benzotriazol-2-yl)-4-methyl-phenyl] ester Formula: C26H18ClN3O4S MolecularWeight: 503.95682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(=O)C2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)Cl)N4N=C5C=CC=CC5=N4

Isomeric SMILES

CC1=CC(=C(C=C1)OC(=O)C2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)Cl)N4N=C5C=CC=CC5=N4

InChI

InChI=1S/C26H18ClN3O4S/c1-17-6-15-25(24(16-17)30-28-22-4-2-3-5-23(22)29-30)34-26(31)18-7-11-20(12-8-18)35(32,33)21-13-9-19(27)10-14-21/h2-16H,1H3