4-[1-[2-(5-chloranyl-2-oxidanylidene-1,3-benzothiazol-3-yl)ethanoyl]piperidin-4-yl]oxy-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[1-[2-(5-chloranyl-2-oxidanylidene-1,3-benzothiazol-3-yl)ethanoyl]piperidin-4-yl]oxy-4-oxidanylidene-butanoic acid Openeye Name: 4-[[1-[2-(5-chloro-2-oxo-1,3-benzothiazol-3-yl)acetyl]-4-piperidyl]oxy]-4-oxo-butanoic acid CAS Name: 4-[[1-[2-(5-chloro-2-oxo-1,3-benzothiazol-3-yl)-1-oxoethyl]-4-piperidinyl]oxy]-4-oxobutanoic acid IUPAC Name: 4-[1-[2-(5-chloro-2-oxo-1,3-benzothiazol-3-yl)acetyl]piperidin-4-yl]oxy-4-oxobutanoic acid Traditional Name: 4-[[1-[2-(5-chloro-2-keto-1,3-benzothiazol-3-yl)acetyl]-4-piperidyl]oxy]-4-keto-butyric acid Formula: C18H19ClN2O6S MolecularWeight: 426.87126

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OC(=O)CCC(=O)O)C(=O)CN2C3=C(C=CC(=C3)Cl)SC2=O

Isomeric SMILES

C1CN(CCC1OC(=O)CCC(=O)O)C(=O)CN2C3=C(C=CC(=C3)Cl)SC2=O

InChI

InChI=1S/C18H19ClN2O6S/c19-11-1-2-14-13(9-11)21(18(26)28-14)10-15(22)20-7-5-12(6-8-20)27-17(25)4-3-16(23)24/h1-2,9,12H,3-8,10H2,(H,23,24)