benzotriazol-2-yl 3-butan-2-yl-4-oxidanyl-benzenesulfonate

Systemtic Name: benzotriazol-2-yl 3-butan-2-yl-4-oxidanyl-benzenesulfonate Openeye Name: benzotriazol-2-yl 4-hydroxy-3-sec-butyl-benzenesulfonate CAS Name: 3-butan-2-yl-4-hydroxybenzenesulfonic acid 2-benzotriazolyl ester IUPAC Name: benzotriazol-2-yl 3-butan-2-yl-4-hydroxybenzenesulfonate Traditional Name: 4-hydroxy-3-sec-butyl-benzenesulfonic acid benzotriazol-2-yl ester Formula: C16H17N3O4S MolecularWeight: 347.38888

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=C(C=CC(=C1)S(=O)(=O)ON2N=C3C=CC=CC3=N2)O

Isomeric SMILES

CCC(C)C1=C(C=CC(=C1)S(=O)(=O)ON2N=C3C=CC=CC3=N2)O

InChI

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