N-(2-morpholin-4-ium-4-ylethyl)-6-morpholin-4-ylsulfonyl-4-oxidanylidene-1H-quinoline-3-carboxamide

Systemtic Name: N-(2-morpholin-4-ium-4-ylethyl)-6-morpholin-4-ylsulfonyl-4-oxidanylidene-1H-quinoline-3-carboxamide Openeye Name: N-(2-morpholin-4-ium-4-ylethyl)-6-morpholinosulfonyl-4-oxo-1H-quinoline-3-carboxamide CAS Name: N-[2-(4-morpholin-4-iumyl)ethyl]-6-(4-morpholinylsulfonyl)-4-oxo-1H-quinoline-3-carboxamide IUPAC Name: N-(2-morpholin-4-ium-4-ylethyl)-6-morpholin-4-ylsulfonyl-4-oxo-1H-quinoline-3-carboxamide Traditional Name: 4-keto-N-(2-morpholin-4-ium-4-ylethyl)-6-morpholinosulfonyl-1H-quinoline-3-carboxamide Formula: C20H27N4O6S+ MolecularWeight: 451.51658

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=O)C2=CNC3=C(C2=O)C=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

C1COCC[NH+]1CCNC(=O)C2=CNC3=C(C2=O)C=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C20H26N4O6S/c25-19-16-13-15(31(27,28)24-7-11-30-12-8-24)1-2-18(16)22-14-17(19)20(26)21-3-4-23-5-9-29-10-6-23/h1-2,13-14H,3-12H2,(H,21,26)(H,22,25)/p+1