phenyl 1-(4-methylphenyl)sulfonylbenzotriazole-5-carboxylate

Systemtic Name: phenyl 1-(4-methylphenyl)sulfonylbenzotriazole-5-carboxylate Openeye Name: phenyl 1-(p-tolylsulfonyl)benzotriazole-5-carboxylate CAS Name: 1-(4-methylphenyl)sulfonyl-5-benzotriazolecarboxylic acid phenyl ester IUPAC Name: phenyl 1-(4-methylphenyl)sulfonylbenzotriazole-5-carboxylate Traditional Name: 1-tosylbenzotriazole-5-carboxylic acid phenyl ester Formula: C20H15N3O4S MolecularWeight: 393.4158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C3=C(C=C(C=C3)C(=O)OC4=CC=CC=C4)N=N2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C3=C(C=C(C=C3)C(=O)OC4=CC=CC=C4)N=N2

InChI

InChI=1S/C20H15N3O4S/c1-14-7-10-17(11-8-14)28(25,26)23-19-12-9-15(13-18(19)21-22-23)20(24)27-16-5-3-2-4-6-16/h2-13H,1H3