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

Systemtic Name: 2-(5-chloranylthiophen-2-yl)-6-morpholin-4-ylsulfonyl-quinoline-4-carboxylic acid Openeye Name: 2-(5-chloro-2-thienyl)-6-morpholinosulfonyl-quinoline-4-carboxylic acid CAS Name: 2-(5-chloro-2-thiophenyl)-6-(4-morpholinylsulfonyl)-4-quinolinecarboxylic acid IUPAC Name: 2-(5-chlorothiophen-2-yl)-6-morpholin-4-ylsulfonylquinoline-4-carboxylic acid Traditional Name: 2-(5-chloro-2-thienyl)-6-morpholinosulfonyl-cinchoninic acid Formula: C18H15ClN2O5S2 MolecularWeight: 438.9051

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC3=C(C=C2)N=C(C=C3C(=O)O)C4=CC=C(S4)Cl

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC3=C(C=C2)N=C(C=C3C(=O)O)C4=CC=C(S4)Cl

InChI

InChI=1S/C18H15ClN2O5S2/c19-17-4-3-16(27-17)15-10-13(18(22)23)12-9-11(1-2-14(12)20-15)28(24,25)21-5-7-26-8-6-21/h1-4,9-10H,5-8H2,(H,22,23)