2-(4-aminophenyl)-1-butyl-benzimidazole-4-sulfonic acid

Systemtic Name: 2-(4-aminophenyl)-1-butyl-benzimidazole-4-sulfonic acid Openeye Name: 2-(4-aminophenyl)-1-butyl-benzimidazole-4-sulfonic acid CAS Name: 2-(4-aminophenyl)-1-butyl-4-benzimidazolesulfonic acid IUPAC Name: 2-(4-aminophenyl)-1-butylbenzimidazole-4-sulfonic acid Traditional Name: 2-(4-aminophenyl)-1-butyl-benzimidazole-4-sulfonic acid Formula: C17H19N3O3S MolecularWeight: 345.41606

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=CC=C2)S(=O)(=O)O)N=C1C3=CC=C(C=C3)N

Isomeric SMILES

CCCCN1C2=C(C(=CC=C2)S(=O)(=O)O)N=C1C3=CC=C(C=C3)N

InChI

InChI=1S/C17H19N3O3S/c1-2-3-11-20-14-5-4-6-15(24(21,22)23)16(14)19-17(20)12-7-9-13(18)10-8-12/h4-10H,2-3,11,18H2,1H3,(H,21,22,23)