1-[2,4-bis(chloranyl)-5-morpholin-4-ylsulfonyl-phenyl]carbonyl-3,4-dihydro-2H-quinoline-5-carboxylic acid

Systemtic Name: 1-[2,4-bis(chloranyl)-5-morpholin-4-ylsulfonyl-phenyl]carbonyl-3,4-dihydro-2H-quinoline-5-carboxylic acid Openeye Name: 1-(2,4-dichloro-5-morpholinosulfonyl-benzoyl)-3,4-dihydro-2H-quinoline-5-carboxylic acid CAS Name: 1-[[2,4-dichloro-5-(4-morpholinylsulfonyl)phenyl]-oxomethyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid IUPAC Name: 1-(2,4-dichloro-5-morpholin-4-ylsulfonylbenzoyl)-3,4-dihydro-2H-quinoline-5-carboxylic acid Traditional Name: 1-(2,4-dichloro-5-morpholinosulfonyl-benzoyl)-3,4-dihydro-2H-quinoline-5-carboxylic acid Formula: C21H20Cl2N2O6S MolecularWeight: 499.3643

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC=C2N(C1)C(=O)C3=CC(=C(C=C3Cl)Cl)S(=O)(=O)N4CCOCC4)C(=O)O

Isomeric SMILES

C1CC2=C(C=CC=C2N(C1)C(=O)C3=CC(=C(C=C3Cl)Cl)S(=O)(=O)N4CCOCC4)C(=O)O

InChI

InChI=1S/C21H20Cl2N2O6S/c22-16-12-17(23)19(32(29,30)24-7-9-31-10-8-24)11-15(16)20(26)25-6-2-4-13-14(21(27)28)3-1-5-18(13)25/h1,3,5,11-12H,2,4,6-10H2,(H,27,28)