2-(5-methylfuran-2-yl)-6-morpholin-4-ylsulfonyl-quinoline-4-carboxylic acid

Systemtic Name: 2-(5-methylfuran-2-yl)-6-morpholin-4-ylsulfonyl-quinoline-4-carboxylic acid Openeye Name: 2-(5-methyl-2-furyl)-6-morpholinosulfonyl-quinoline-4-carboxylic acid CAS Name: 2-(5-methyl-2-furanyl)-6-(4-morpholinylsulfonyl)-4-quinolinecarboxylic acid IUPAC Name: 2-(5-methylfuran-2-yl)-6-morpholin-4-ylsulfonylquinoline-4-carboxylic acid Traditional Name: 2-(5-methyl-2-furyl)-6-morpholinosulfonyl-cinchoninic acid Formula: C19H18N2O6S MolecularWeight: 402.42102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=NC3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)C(=C2)C(=O)O

Isomeric SMILES

CC1=CC=C(O1)C2=NC3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)C(=C2)C(=O)O

InChI

InChI=1S/C19H18N2O6S/c1-12-2-5-18(27-12)17-11-15(19(22)23)14-10-13(3-4-16(14)20-17)28(24,25)21-6-8-26-9-7-21/h2-5,10-11H,6-9H2,1H3,(H,22,23)