4-[(Z)-2-chloranyl-2-(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)ethenyl]benzoic acid

Systemtic Name: 4-[(Z)-2-chloranyl-2-(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)ethenyl]benzoic acid Openeye Name: 4-[(Z)-2-chloro-2-[1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]vinyl]benzoic acid CAS Name: 4-[(Z)-2-chloro-2-[1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]ethenyl]benzoic acid IUPAC Name: 4-[(Z)-2-chloro-2-(1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)ethenyl]benzoic acid Traditional Name: 4-[(Z)-2-chloro-2-(1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)vinyl]benzoic acid Formula: C23H24ClN3O4S MolecularWeight: 473.97236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1C(=CC4=CC=C(C=C4)C(=O)O)Cl

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1/C(=C/C4=CC=C(C=C4)C(=O)O)/Cl

InChI

InChI=1S/C23H24ClN3O4S/c1-2-27-21-11-10-18(32(30,31)26-12-4-3-5-13-26)15-20(21)25-22(27)19(24)14-16-6-8-17(9-7-16)23(28)29/h6-11,14-15H,2-5,12-13H2,1H3,(H,28,29)/b19-14-