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

Systemtic Name: 2-[3-chloranyl-4-[1-(ethyliminomethyl)piperidin-4-yl]oxy-phenyl]-2-sulfamoyl-ethanoic acid Openeye Name: 2-[3-chloro-4-[[1-(ethyliminomethyl)-4-piperidyl]oxy]phenyl]-2-sulfamoyl-acetic acid CAS Name: 2-[3-chloro-4-[[1-(ethyliminomethyl)-4-piperidinyl]oxy]phenyl]-2-sulfamoylacetic acid IUPAC Name: 2-[3-chloro-4-[1-(ethyliminomethyl)piperidin-4-yl]oxyphenyl]-2-sulfamoylacetic acid Traditional Name: 2-[3-chloro-4-[[1-(ethyliminomethyl)-4-piperidyl]oxy]phenyl]-2-sulfamoyl-acetic acid Formula: C16H22ClN3O5S MolecularWeight: 403.88098

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Descriptors Computed from Structure

Canonical SMILES:

CCN=CN1CCC(CC1)OC2=C(C=C(C=C2)C(C(=O)O)S(=O)(=O)N)Cl

Isomeric SMILES

CCN=CN1CCC(CC1)OC2=C(C=C(C=C2)C(C(=O)O)S(=O)(=O)N)Cl

InChI

InChI=1S/C16H22ClN3O5S/c1-2-19-10-20-7-5-12(6-8-20)25-14-4-3-11(9-13(14)17)15(16(21)22)26(18,23)24/h3-4,9-10,12,15H,2,5-8H2,1H3,(H,21,22)(H2,18,23,24)