benzenesulfonic acid; 2,4,6-trimethylpyridin-3-ol

Systemtic Name: benzenesulfonic acid; 2,4,6-trimethylpyridin-3-ol Openeye Name: benzenesulfonic acid; 2,4,6-trimethylpyridin-3-ol CAS Name: benzenesulfonic acid; 2,4,6-trimethyl-3-pyridinol IUPAC Name: benzenesulfonic acid; 2,4,6-trimethylpyridin-3-ol Traditional Name: besylic acid; 2,4,6-trimethylpyridin-3-ol Formula: C14H17NO4S MolecularWeight: 295.35408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1O)C)C.C1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CC1=CC(=NC(=C1O)C)C.C1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C8H11NO.C6H6O3S/c1-5-4-6(2)9-7(3)8(5)10;7-10(8,9)6-4-2-1-3-5-6/h4,10H,1-3H3;1-5H,(H,7,8,9)