N'-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]-N-(3-morpholin-4-ium-4-ylpropyl)ethanediamide

Systemtic Name: N'-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]-N-(3-morpholin-4-ium-4-ylpropyl)ethanediamide Openeye Name: N'-[[4-(4-methoxyphenyl)tetrahydropyran-4-yl]methyl]-N-(3-morpholin-4-ium-4-ylpropyl)oxamide CAS Name: N'-[[4-(4-methoxyphenyl)-4-oxanyl]methyl]-N-[3-(4-morpholin-4-iumyl)propyl]oxamide IUPAC Name: N'-[[4-(4-methoxyphenyl)oxan-4-yl]methyl]-N-(3-morpholin-4-ium-4-ylpropyl)oxamide Traditional Name: N'-[[4-(4-methoxyphenyl)tetrahydropyran-4-yl]methyl]-N-(3-morpholin-4-ium-4-ylpropyl)oxamide Formula: C22H34N3O5+ MolecularWeight: 420.52246

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2(CCOCC2)CNC(=O)C(=O)NCCC[NH+]3CCOCC3

Isomeric SMILES

COC1=CC=C(C=C1)C2(CCOCC2)CNC(=O)C(=O)NCCC[NH+]3CCOCC3

InChI

InChI=1S/C22H33N3O5/c1-28-19-5-3-18(4-6-19)22(7-13-29-14-8-22)17-24-21(27)20(26)23-9-2-10-25-11-15-30-16-12-25/h3-6H,2,7-17H2,1H3,(H,23,26)(H,24,27)/p+1