2-(2-ethoxyphenyl)-6-morpholin-4-ylsulfonyl-quinoline-4-carboxylic acid

Systemtic Name: 2-(2-ethoxyphenyl)-6-morpholin-4-ylsulfonyl-quinoline-4-carboxylic acid Openeye Name: 2-(2-ethoxyphenyl)-6-morpholinosulfonyl-quinoline-4-carboxylic acid CAS Name: 2-(2-ethoxyphenyl)-6-(4-morpholinylsulfonyl)-4-quinolinecarboxylic acid IUPAC Name: 2-(2-ethoxyphenyl)-6-morpholin-4-ylsulfonylquinoline-4-carboxylic acid Traditional Name: 6-morpholinosulfonyl-2-o-phenetyl-cinchoninic acid Formula: C22H22N2O6S MolecularWeight: 442.48488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2=NC3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)C(=C2)C(=O)O

Isomeric SMILES

CCOC1=CC=CC=C1C2=NC3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)C(=C2)C(=O)O

InChI

InChI=1S/C22H22N2O6S/c1-2-30-21-6-4-3-5-16(21)20-14-18(22(25)26)17-13-15(7-8-19(17)23-20)31(27,28)24-9-11-29-12-10-24/h3-8,13-14H,2,9-12H2,1H3,(H,25,26)