4-(4-methoxyphenyl)-N-[4-(2-morpholin-4-ium-4-ylethylcarbamoyl)phenyl]oxane-4-carboxamide

Systemtic Name: 4-(4-methoxyphenyl)-N-[4-(2-morpholin-4-ium-4-ylethylcarbamoyl)phenyl]oxane-4-carboxamide Openeye Name: 4-(4-methoxyphenyl)-N-[4-(2-morpholin-4-ium-4-ylethylcarbamoyl)phenyl]tetrahydropyran-4-carboxamide CAS Name: 4-(4-methoxyphenyl)-N-[4-[[2-(4-morpholin-4-iumyl)ethylamino]-oxomethyl]phenyl]-4-oxanecarboxamide IUPAC Name: 4-(4-methoxyphenyl)-N-[4-(2-morpholin-4-ium-4-ylethylcarbamoyl)phenyl]oxane-4-carboxamide Traditional Name: 4-(4-methoxyphenyl)-N-[4-(2-morpholin-4-ium-4-ylethylcarbamoyl)phenyl]tetrahydropyran-4-carboxamide Formula: C26H34N3O5+ MolecularWeight: 468.56526

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2(CCOCC2)C(=O)NC3=CC=C(C=C3)C(=O)NCC[NH+]4CCOCC4

Isomeric SMILES

COC1=CC=C(C=C1)C2(CCOCC2)C(=O)NC3=CC=C(C=C3)C(=O)NCC[NH+]4CCOCC4

InChI

InChI=1S/C26H33N3O5/c1-32-23-8-4-21(5-9-23)26(10-16-33-17-11-26)25(31)28-22-6-2-20(3-7-22)24(30)27-12-13-29-14-18-34-19-15-29/h2-9H,10-19H2,1H3,(H,27,30)(H,28,31)/p+1