2-[3-chloranyl-4-(1-pyridin-4-ylpiperidin-4-yl)oxy-phenyl]-2-sulfamoyl-ethanoic acid

Systemtic Name: 2-[3-chloranyl-4-(1-pyridin-4-ylpiperidin-4-yl)oxy-phenyl]-2-sulfamoyl-ethanoic acid Openeye Name: 2-[3-chloro-4-[[1-(4-pyridyl)-4-piperidyl]oxy]phenyl]-2-sulfamoyl-acetic acid CAS Name: 2-[3-chloro-4-[(1-pyridin-4-yl-4-piperidinyl)oxy]phenyl]-2-sulfamoylacetic acid IUPAC Name: 2-[3-chloro-4-(1-pyridin-4-ylpiperidin-4-yl)oxyphenyl]-2-sulfamoylacetic acid Traditional Name: 2-[3-chloro-4-[[1-(4-pyridyl)-4-piperidyl]oxy]phenyl]-2-sulfamoyl-acetic acid Formula: C18H20ClN3O5S MolecularWeight: 425.8865

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OC2=C(C=C(C=C2)C(C(=O)O)S(=O)(=O)N)Cl)C3=CC=NC=C3

Isomeric SMILES

C1CN(CCC1OC2=C(C=C(C=C2)C(C(=O)O)S(=O)(=O)N)Cl)C3=CC=NC=C3

InChI

InChI=1S/C18H20ClN3O5S/c19-15-11-12(17(18(23)24)28(20,25)26)1-2-16(15)27-14-5-9-22(10-6-14)13-3-7-21-8-4-13/h1-4,7-8,11,14,17H,5-6,9-10H2,(H,23,24)(H2,20,25,26)