2-(3-ethoxyphenyl)-6-morpholin-4-ylsulfonyl-quinoline-4-carboxylic acid

Systemtic Name: 2-(3-ethoxyphenyl)-6-morpholin-4-ylsulfonyl-quinoline-4-carboxylic acid Openeye Name: 2-(3-ethoxyphenyl)-6-morpholinosulfonyl-quinoline-4-carboxylic acid CAS Name: 2-(3-ethoxyphenyl)-6-(4-morpholinylsulfonyl)-4-quinolinecarboxylic acid IUPAC Name: 2-(3-ethoxyphenyl)-6-morpholin-4-ylsulfonylquinoline-4-carboxylic acid Traditional Name: 6-morpholinosulfonyl-2-m-phenetyl-cinchoninic acid Formula: C22H22N2O6S MolecularWeight: 442.48488

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C2=NC3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)C(=C2)C(=O)O

Isomeric SMILES

CCOC1=CC=CC(=C1)C2=NC3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)C(=C2)C(=O)O

InChI

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