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

Systemtic Name: 2-(4-ethylphenyl)-6-morpholin-4-ylsulfonyl-quinoline-4-carboxylic acid Openeye Name: 2-(4-ethylphenyl)-6-morpholinosulfonyl-quinoline-4-carboxylic acid CAS Name: 2-(4-ethylphenyl)-6-(4-morpholinylsulfonyl)-4-quinolinecarboxylic acid IUPAC Name: 2-(4-ethylphenyl)-6-morpholin-4-ylsulfonylquinoline-4-carboxylic acid Traditional Name: 2-(4-ethylphenyl)-6-morpholinosulfonyl-cinchoninic acid Formula: C22H22N2O5S MolecularWeight: 426.48548

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)C(=C2)C(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)C(=C2)C(=O)O

InChI

InChI=1S/C22H22N2O5S/c1-2-15-3-5-16(6-4-15)21-14-19(22(25)26)18-13-17(7-8-20(18)23-21)30(27,28)24-9-11-29-12-10-24/h3-8,13-14H,2,9-12H2,1H3,(H,25,26)