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

Systemtic Name: [2-(benzotriazol-2-yl)-4-methyl-phenyl] 4-chloranylbenzenesulfonate Openeye Name: [2-(benzotriazol-2-yl)-4-methyl-phenyl] 4-chlorobenzenesulfonate CAS Name: 4-chlorobenzenesulfonic acid [2-(2-benzotriazolyl)-4-methylphenyl] ester IUPAC Name: [2-(benzotriazol-2-yl)-4-methylphenyl] 4-chlorobenzenesulfonate Traditional Name: 4-chlorobenzenesulfonic acid [2-(benzotriazol-2-yl)-4-methyl-phenyl] ester Formula: C19H14ClN3O3S MolecularWeight: 399.85076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)Cl)N3N=C4C=CC=CC4=N3

Isomeric SMILES

CC1=CC(=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)Cl)N3N=C4C=CC=CC4=N3

InChI

InChI=1S/C19H14ClN3O3S/c1-13-6-11-19(26-27(24,25)15-9-7-14(20)8-10-15)18(12-13)23-21-16-4-2-3-5-17(16)22-23/h2-12H,1H3