[4-(2-hydroxyethyloxy)-3-methoxy-phenyl]methyl-(3-morpholin-4-ium-4-ylpropyl)azanium

Systemtic Name: [4-(2-hydroxyethyloxy)-3-methoxy-phenyl]methyl-(3-morpholin-4-ium-4-ylpropyl)azanium Openeye Name: [4-(2-hydroxyethoxy)-3-methoxy-phenyl]methyl-(3-morpholin-4-ium-4-ylpropyl)ammonium CAS Name: [4-(2-hydroxyethoxy)-3-methoxyphenyl]methyl-[3-(4-morpholin-4-iumyl)propyl]ammonium IUPAC Name: [4-(2-hydroxyethoxy)-3-methoxyphenyl]methyl-(3-morpholin-4-ium-4-ylpropyl)azanium Traditional Name: [4-(2-hydroxyethoxy)-3-methoxy-benzyl]-(3-morpholin-4-ium-4-ylpropyl)ammonium Formula: C17H30N2O4+2 MolecularWeight: 326.4311

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C[NH2+]CCC[NH+]2CCOCC2)OCCO

Isomeric SMILES

COC1=C(C=CC(=C1)C[NH2+]CCC[NH+]2CCOCC2)OCCO

InChI

InChI=1S/C17H28N2O4/c1-21-17-13-15(3-4-16(17)23-12-9-20)14-18-5-2-6-19-7-10-22-11-8-19/h3-4,13,18,20H,2,5-12,14H2,1H3/p+2