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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CN2C3=C(C=CC=C3Cl)SC2=O)OC(=O)CCC(=O)O

Isomeric SMILES

C1CC(CN(C1)C(=O)CN2C3=C(C=CC=C3Cl)SC2=O)OC(=O)CCC(=O)O

InChI

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