3-[4-(6-chloranyl-1H-benzimidazol-2-yl)piperidin-1-yl]sulfonylbenzoic acid

Systemtic Name: 3-[4-(6-chloranyl-1H-benzimidazol-2-yl)piperidin-1-yl]sulfonylbenzoic acid Openeye Name: 3-[[4-(6-chloro-1H-benzimidazol-2-yl)-1-piperidyl]sulfonyl]benzoic acid CAS Name: 3-[[4-(6-chloro-1H-benzimidazol-2-yl)-1-piperidinyl]sulfonyl]benzoic acid IUPAC Name: 3-[4-(6-chloro-1H-benzimidazol-2-yl)piperidin-1-yl]sulfonylbenzoic acid Traditional Name: 3-[4-(6-chloro-1H-benzimidazol-2-yl)piperidino]sulfonylbenzoic acid Formula: C19H18ClN3O4S MolecularWeight: 419.88192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=C(N2)C=C(C=C3)Cl)S(=O)(=O)C4=CC=CC(=C4)C(=O)O

Isomeric SMILES

C1CN(CCC1C2=NC3=C(N2)C=C(C=C3)Cl)S(=O)(=O)C4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C19H18ClN3O4S/c20-14-4-5-16-17(11-14)22-18(21-16)12-6-8-23(9-7-12)28(26,27)15-3-1-2-13(10-15)19(24)25/h1-5,10-12H,6-9H2,(H,21,22)(H,24,25)