1-methyl-5-(1-methylbenzimidazol-2-yl)pyrrole-3-sulfonic acid

Systemtic Name: 1-methyl-5-(1-methylbenzimidazol-2-yl)pyrrole-3-sulfonic acid Openeye Name: 1-methyl-5-(1-methylbenzimidazol-2-yl)pyrrole-3-sulfonic acid CAS Name: 1-methyl-5-(1-methyl-2-benzimidazolyl)-3-pyrrolesulfonic acid IUPAC Name: 1-methyl-5-(1-methylbenzimidazol-2-yl)pyrrole-3-sulfonic acid Traditional Name: 1-methyl-5-(1-methylbenzimidazol-2-yl)pyrrole-3-sulfonic acid Formula: C13H13N3O3S MolecularWeight: 291.32562

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C2=NC3=CC=CC=C3N2C)S(=O)(=O)O

Isomeric SMILES

CN1C=C(C=C1C2=NC3=CC=CC=C3N2C)S(=O)(=O)O

InChI

InChI=1S/C13H13N3O3S/c1-15-8-9(20(17,18)19)7-12(15)13-14-10-5-3-4-6-11(10)16(13)2/h3-8H,1-2H3,(H,17,18,19)