[2-(benzotriazol-2-yl)-4,6-ditert-butyl-phenyl] 4-methylbenzenesulfonate

Systemtic Name: [2-(benzotriazol-2-yl)-4,6-ditert-butyl-phenyl] 4-methylbenzenesulfonate Openeye Name: [2-(benzotriazol-2-yl)-4,6-ditert-butyl-phenyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-(2-benzotriazolyl)-4,6-ditert-butylphenyl] ester IUPAC Name: [2-(benzotriazol-2-yl)-4,6-ditert-butylphenyl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-(benzotriazol-2-yl)-4,6-ditert-butyl-phenyl] ester Formula: C27H31N3O3S MolecularWeight: 477.61834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2N3N=C4C=CC=CC4=N3)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2N3N=C4C=CC=CC4=N3)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C27H31N3O3S/c1-18-12-14-20(15-13-18)34(31,32)33-25-21(27(5,6)7)16-19(26(2,3)4)17-24(25)30-28-22-10-8-9-11-23(22)29-30/h8-17H,1-7H3