6-morpholin-4-yl-N-(5-morpholin-4-ylsulfonyl-2-propan-2-yloxy-phenyl)pyridin-1-ium-3-carboxamide

Systemtic Name: 6-morpholin-4-yl-N-(5-morpholin-4-ylsulfonyl-2-propan-2-yloxy-phenyl)pyridin-1-ium-3-carboxamide Openeye Name: N-(2-isopropoxy-5-morpholinosulfonyl-phenyl)-6-morpholino-pyridin-1-ium-3-carboxamide CAS Name: 6-(4-morpholinyl)-N-[5-(4-morpholinylsulfonyl)-2-propan-2-yloxyphenyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 6-morpholin-4-yl-N-(5-morpholin-4-ylsulfonyl-2-propan-2-yloxyphenyl)pyridin-1-ium-3-carboxamide Traditional Name: N-(2-isopropoxy-5-morpholinosulfonyl-phenyl)-6-morpholino-pyridin-1-ium-3-carboxamide Formula: C23H31N4O6S+ MolecularWeight: 491.58044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C3=C[NH+]=C(C=C3)N4CCOCC4

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)C3=C[NH+]=C(C=C3)N4CCOCC4

InChI

InChI=1S/C23H30N4O6S/c1-17(2)33-21-5-4-19(34(29,30)27-9-13-32-14-10-27)15-20(21)25-23(28)18-3-6-22(24-16-18)26-7-11-31-12-8-26/h3-6,15-17H,7-14H2,1-2H3,(H,25,28)/p+1