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

Systemtic Name: 1-[3-[(2,4-dimethylquinolin-8-yl)oxymethyl]-2,4-dimethoxy-phenyl]sulfonylpyrrolidine-2-carboxylic acid Openeye Name: 1-[3-[(2,4-dimethyl-8-quinolyl)oxymethyl]-2,4-dimethoxy-phenyl]sulfonylpyrrolidine-2-carboxylic acid CAS Name: 1-[3-[(2,4-dimethyl-8-quinolinyl)oxymethyl]-2,4-dimethoxyphenyl]sulfonyl-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[3-[(2,4-dimethylquinolin-8-yl)oxymethyl]-2,4-dimethoxyphenyl]sulfonylpyrrolidine-2-carboxylic acid Traditional Name: 1-[3-[(2,4-dimethyl-8-quinolyl)oxymethyl]-2,4-dimethoxy-phenyl]sulfonylproline Formula: C25H28N2O7S MolecularWeight: 500.56402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=CC=C2OCC3=C(C=CC(=C3OC)S(=O)(=O)N4CCCC4C(=O)O)OC)C

Isomeric SMILES

CC1=CC(=NC2=C1C=CC=C2OCC3=C(C=CC(=C3OC)S(=O)(=O)N4CCCC4C(=O)O)OC)C

InChI

InChI=1S/C25H28N2O7S/c1-15-13-16(2)26-23-17(15)7-5-9-21(23)34-14-18-20(32-3)10-11-22(24(18)33-4)35(30,31)27-12-6-8-19(27)25(28)29/h5,7,9-11,13,19H,6,8,12,14H2,1-4H3,(H,28,29)