3-(benzotriazol-2-yl)-5-butan-2-yl-2-oxidanyl-benzenesulfonic acid

Systemtic Name: 3-(benzotriazol-2-yl)-5-butan-2-yl-2-oxidanyl-benzenesulfonic acid Openeye Name: 3-(benzotriazol-2-yl)-2-hydroxy-5-sec-butyl-benzenesulfonic acid CAS Name: 3-(2-benzotriazolyl)-5-butan-2-yl-2-hydroxybenzenesulfonic acid IUPAC Name: 3-(benzotriazol-2-yl)-5-butan-2-yl-2-hydroxybenzenesulfonic acid Traditional Name: 3-(benzotriazol-2-yl)-2-hydroxy-5-sec-butyl-besylic acid Formula: C16H17N3O4S MolecularWeight: 347.38888

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC(=C(C(=C1)S(=O)(=O)O)O)N2N=C3C=CC=CC3=N2

Isomeric SMILES

CCC(C)C1=CC(=C(C(=C1)S(=O)(=O)O)O)N2N=C3C=CC=CC3=N2

InChI

InChI=1S/C16H17N3O4S/c1-3-10(2)11-8-14(16(20)15(9-11)24(21,22)23)19-17-12-6-4-5-7-13(12)18-19/h4-10,20H,3H2,1-2H3,(H,21,22,23)