4-oxidanylidene-3-[[2-(2-quinolin-5-ylethoxy)phenyl]sulfonylamino]butanoic acid

Systemtic Name: 4-oxidanylidene-3-[[2-(2-quinolin-5-ylethoxy)phenyl]sulfonylamino]butanoic acid Openeye Name: 4-oxo-3-[[2-[2-(5-quinolyl)ethoxy]phenyl]sulfonylamino]butanoic acid CAS Name: 4-oxo-3-[[2-[2-(5-quinolinyl)ethoxy]phenyl]sulfonylamino]butanoic acid IUPAC Name: 4-oxo-3-[[2-(2-quinolin-5-ylethoxy)phenyl]sulfonylamino]butanoic acid Traditional Name: 4-keto-3-[[2-[2-(5-quinolyl)ethoxy]phenyl]sulfonylamino]butyric acid Formula: C21H20N2O6S MolecularWeight: 428.4583

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)OCCC2=C3C=CC=NC3=CC=C2)S(=O)(=O)NC(CC(=O)O)C=O

Isomeric SMILES

C1=CC=C(C(=C1)OCCC2=C3C=CC=NC3=CC=C2)S(=O)(=O)NC(CC(=O)O)C=O

InChI

InChI=1S/C21H20N2O6S/c24-14-16(13-21(25)26)23-30(27,28)20-9-2-1-8-19(20)29-12-10-15-5-3-7-18-17(15)6-4-11-22-18/h1-9,11,14,16,23H,10,12-13H2,(H,25,26)