(3-morpholin-4-ylpropylamino) 5-chloranyl-2-methyl-8-oxidanyl-quinoline-7-sulfinate

Systemtic Name: (3-morpholin-4-ylpropylamino) 5-chloranyl-2-methyl-8-oxidanyl-quinoline-7-sulfinate Openeye Name: (3-morpholinopropylamino) 5-chloro-8-hydroxy-2-methyl-quinoline-7-sulfinate CAS Name: 5-chloro-8-hydroxy-2-methyl-7-quinolinesulfinic acid [3-(4-morpholinyl)propylamino] ester IUPAC Name: (3-morpholin-4-ylpropylamino) 5-chloro-8-hydroxy-2-methylquinoline-7-sulfinate Traditional Name: 5-chloro-8-hydroxy-2-methyl-quinoline-7-sulfinic acid (3-morpholinopropylamino) ester Formula: C17H22ClN3O4S MolecularWeight: 399.89228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=CC(=C2C=C1)Cl)S(=O)ONCCCN3CCOCC3)O

Isomeric SMILES

CC1=NC2=C(C(=CC(=C2C=C1)Cl)S(=O)ONCCCN3CCOCC3)O

InChI

InChI=1S/C17H22ClN3O4S/c1-12-3-4-13-14(18)11-15(17(22)16(13)20-12)26(23)25-19-5-2-6-21-7-9-24-10-8-21/h3-4,11,19,22H,2,5-10H2,1H3