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

Systemtic Name: 3-[[4-acetamido-2-(2-quinolin-5-ylpropoxy)phenyl]sulfonylamino]-4-oxidanylidene-butanoic acid Openeye Name: 3-[[4-acetamido-2-[2-(5-quinolyl)propoxy]phenyl]sulfonylamino]-4-oxo-butanoic acid CAS Name: 3-[[4-acetamido-2-[2-(5-quinolinyl)propoxy]phenyl]sulfonylamino]-4-oxobutanoic acid IUPAC Name: 3-[[4-acetamido-2-(2-quinolin-5-ylpropoxy)phenyl]sulfonylamino]-4-oxobutanoic acid Traditional Name: 3-[[4-acetamido-2-[2-(5-quinolyl)propoxy]phenyl]sulfonylamino]-4-keto-butyric acid Formula: C24H25N3O7S MolecularWeight: 499.5362

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=C(C=CC(=C1)NC(=O)C)S(=O)(=O)NC(CC(=O)O)C=O)C2=C3C=CC=NC3=CC=C2

Isomeric SMILES

CC(COC1=C(C=CC(=C1)NC(=O)C)S(=O)(=O)NC(CC(=O)O)C=O)C2=C3C=CC=NC3=CC=C2

InChI

InChI=1S/C24H25N3O7S/c1-15(19-5-3-7-21-20(19)6-4-10-25-21)14-34-22-11-17(26-16(2)29)8-9-23(22)35(32,33)27-18(13-28)12-24(30)31/h3-11,13,15,18,27H,12,14H2,1-2H3,(H,26,29)(H,30,31)