3-[4-(5-fluoranylbenzimidazol-1-yl)piperidin-1-yl]sulfonylbenzoic acid

Systemtic Name: 3-[4-(5-fluoranylbenzimidazol-1-yl)piperidin-1-yl]sulfonylbenzoic acid Openeye Name: 3-[[4-(5-fluorobenzimidazol-1-yl)-1-piperidyl]sulfonyl]benzoic acid CAS Name: 3-[[4-(5-fluoro-1-benzimidazolyl)-1-piperidinyl]sulfonyl]benzoic acid IUPAC Name: 3-[4-(5-fluorobenzimidazol-1-yl)piperidin-1-yl]sulfonylbenzoic acid Traditional Name: 3-[4-(5-fluorobenzimidazol-1-yl)piperidino]sulfonylbenzoic acid Formula: C19H18FN3O4S MolecularWeight: 403.427323

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C=NC3=C2C=CC(=C3)F)S(=O)(=O)C4=CC=CC(=C4)C(=O)O

Isomeric SMILES

C1CN(CCC1N2C=NC3=C2C=CC(=C3)F)S(=O)(=O)C4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C19H18FN3O4S/c20-14-4-5-18-17(11-14)21-12-23(18)15-6-8-22(9-7-15)28(26,27)16-3-1-2-13(10-16)19(24)25/h1-5,10-12,15H,6-9H2,(H,24,25)