4-[1-[2-(7-chloranyl-2-oxidanylidene-1,3-benzothiazol-3-yl)ethanoyl]piperidin-4-yl]oxy-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[1-[2-(7-chloranyl-2-oxidanylidene-1,3-benzothiazol-3-yl)ethanoyl]piperidin-4-yl]oxy-4-oxidanylidene-butanoic acid Openeye Name: 4-[[1-[2-(7-chloro-2-oxo-1,3-benzothiazol-3-yl)acetyl]-4-piperidyl]oxy]-4-oxo-butanoic acid CAS Name: 4-[[1-[2-(7-chloro-2-oxo-1,3-benzothiazol-3-yl)-1-oxoethyl]-4-piperidinyl]oxy]-4-oxobutanoic acid IUPAC Name: 4-[1-[2-(7-chloro-2-oxo-1,3-benzothiazol-3-yl)acetyl]piperidin-4-yl]oxy-4-oxobutanoic acid Traditional Name: 4-[[1-[2-(7-chloro-2-keto-1,3-benzothiazol-3-yl)acetyl]-4-piperidyl]oxy]-4-keto-butyric acid Formula: C18H19ClN2O6S MolecularWeight: 426.87126

Click to see the large picture

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