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

Systemtic Name: 3-(benzotriazol-2-yl)-5-methyl-4-oxidanyl-benzenesulfonic acid Openeye Name: 3-(benzotriazol-2-yl)-4-hydroxy-5-methyl-benzenesulfonic acid CAS Name: 3-(2-benzotriazolyl)-4-hydroxy-5-methylbenzenesulfonic acid IUPAC Name: 3-(benzotriazol-2-yl)-4-hydroxy-5-methylbenzenesulfonic acid Traditional Name: 3-(benzotriazol-2-yl)-4-hydroxy-5-methyl-besylic acid Formula: C13H11N3O4S MolecularWeight: 305.30914

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11N3O4S/c1-8-6-9(21(18,19)20)7-12(13(8)17)16-14-10-4-2-3-5-11(10)15-16/h2-7,17H,1H3,(H,18,19,20)