4-(4-butoxy-3-methoxy-phenyl)-2-morpholin-4-yl-4-oxidanylidene-butanoate; morpholin-4-ium

Systemtic Name: 4-(4-butoxy-3-methoxy-phenyl)-2-morpholin-4-yl-4-oxidanylidene-butanoate; morpholin-4-ium Openeye Name: 4-(4-butoxy-3-methoxy-phenyl)-2-morpholino-4-oxo-butanoate; morpholin-4-ium CAS Name: 4-(4-butoxy-3-methoxyphenyl)-2-(4-morpholinyl)-4-oxobutanoate; morpholin-4-ium IUPAC Name: 4-(4-butoxy-3-methoxyphenyl)-2-morpholin-4-yl-4-oxobutanoate; morpholin-4-ium Traditional Name: 4-(4-butoxy-3-methoxy-phenyl)-4-keto-2-morpholino-butyrate; morpholin-4-ium Formula: C23H36N2O7 MolecularWeight: 452.54114

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)CC(C(=O)[O-])N2CCOCC2)OC.C1COCC[NH2+]1

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)CC(C(=O)[O-])N2CCOCC2)OC.C1COCC[NH2+]1

InChI

InChI=1S/C19H27NO6.C4H9NO/c1-3-4-9-26-17-6-5-14(12-18(17)24-2)16(21)13-15(19(22)23)20-7-10-25-11-8-20;1-3-6-4-2-5-1/h5-6,12,15H,3-4,7-11,13H2,1-2H3,(H,22,23);5H,1-4H2