1-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)carbonyl-3,4-dihydro-2H-quinoline-5-carboxylic acid

Systemtic Name: 1-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)carbonyl-3,4-dihydro-2H-quinoline-5-carboxylic acid Openeye Name: 1-(4-methoxy-3-morpholinosulfonyl-benzoyl)-3,4-dihydro-2H-quinoline-5-carboxylic acid CAS Name: 1-[[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]-oxomethyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid IUPAC Name: 1-(4-methoxy-3-morpholin-4-ylsulfonylbenzoyl)-3,4-dihydro-2H-quinoline-5-carboxylic acid Traditional Name: 1-(4-methoxy-3-morpholinosulfonyl-benzoyl)-3,4-dihydro-2H-quinoline-5-carboxylic acid Formula: C22H24N2O7S MolecularWeight: 460.50016

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCCC3=C(C=CC=C32)C(=O)O)S(=O)(=O)N4CCOCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCCC3=C(C=CC=C32)C(=O)O)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H24N2O7S/c1-30-19-8-7-15(14-20(19)32(28,29)23-10-12-31-13-11-23)21(25)24-9-3-5-16-17(22(26)27)4-2-6-18(16)24/h2,4,6-8,14H,3,5,9-13H2,1H3,(H,26,27)