2-imidazol-1-yl-4-methyl-benzenesulfonic acid

Systemtic Name: 2-imidazol-1-yl-4-methyl-benzenesulfonic acid Openeye Name: 2-imidazol-1-yl-4-methyl-benzenesulfonic acid CAS Name: 2-(1-imidazolyl)-4-methylbenzenesulfonic acid IUPAC Name: 2-imidazol-1-yl-4-methylbenzenesulfonic acid Traditional Name: 2-imidazol-1-yl-4-methyl-besylic acid Formula: C10H10N2O3S MolecularWeight: 238.263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)O)N2C=CN=C2

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)O)N2C=CN=C2

InChI

InChI=1S/C10H10N2O3S/c1-8-2-3-10(16(13,14)15)9(6-8)12-5-4-11-7-12/h2-7H,1H3,(H,13,14,15)