1-[3-[(2,4-dimethylquinolin-8-yl)oxymethyl]-2,4-dimethyl-phenyl]sulfonylpyrrolidine-2-carboxylic acid

Systemtic Name: 1-[3-[(2,4-dimethylquinolin-8-yl)oxymethyl]-2,4-dimethyl-phenyl]sulfonylpyrrolidine-2-carboxylic acid Openeye Name: 1-[3-[(2,4-dimethyl-8-quinolyl)oxymethyl]-2,4-dimethyl-phenyl]sulfonylpyrrolidine-2-carboxylic acid CAS Name: 1-[3-[(2,4-dimethyl-8-quinolinyl)oxymethyl]-2,4-dimethylphenyl]sulfonyl-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[3-[(2,4-dimethylquinolin-8-yl)oxymethyl]-2,4-dimethylphenyl]sulfonylpyrrolidine-2-carboxylic acid Traditional Name: 1-[3-[(2,4-dimethyl-8-quinolyl)oxymethyl]-2,4-dimethyl-phenyl]sulfonylproline Formula: C25H28N2O5S MolecularWeight: 468.56522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)S(=O)(=O)N2CCCC2C(=O)O)C)COC3=CC=CC4=C3N=C(C=C4C)C

Isomeric SMILES

CC1=C(C(=C(C=C1)S(=O)(=O)N2CCCC2C(=O)O)C)COC3=CC=CC4=C3N=C(C=C4C)C

InChI

InChI=1S/C25H28N2O5S/c1-15-10-11-23(33(30,31)27-12-6-8-21(27)25(28)29)18(4)20(15)14-32-22-9-5-7-19-16(2)13-17(3)26-24(19)22/h5,7,9-11,13,21H,6,8,12,14H2,1-4H3,(H,28,29)