3-(benzotriazol-2-yl)-5-(2-methylpropyl)-4-oxidanyl-benzenesulfonic acid

Systemtic Name: 3-(benzotriazol-2-yl)-5-(2-methylpropyl)-4-oxidanyl-benzenesulfonic acid Openeye Name: 3-(benzotriazol-2-yl)-4-hydroxy-5-isobutyl-benzenesulfonic acid CAS Name: 3-(2-benzotriazolyl)-4-hydroxy-5-(2-methylpropyl)benzenesulfonic acid IUPAC Name: 3-(benzotriazol-2-yl)-4-hydroxy-5-(2-methylpropyl)benzenesulfonic acid Traditional Name: 3-(benzotriazol-2-yl)-4-hydroxy-5-isobutyl-besylic acid Formula: C16H17N3O4S MolecularWeight: 347.38888

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC(=CC(=C1O)N2N=C3C=CC=CC3=N2)S(=O)(=O)O

Isomeric SMILES

CC(C)CC1=CC(=CC(=C1O)N2N=C3C=CC=CC3=N2)S(=O)(=O)O

InChI

InChI=1S/C16H17N3O4S/c1-10(2)7-11-8-12(24(21,22)23)9-15(16(11)20)19-17-13-5-3-4-6-14(13)18-19/h3-6,8-10,20H,7H2,1-2H3,(H,21,22,23)