(4-ethoxy-3-methoxy-phenyl)methyl-(3-morpholin-4-ium-4-ylpropyl)azanium

Systemtic Name: (4-ethoxy-3-methoxy-phenyl)methyl-(3-morpholin-4-ium-4-ylpropyl)azanium Openeye Name: (4-ethoxy-3-methoxy-phenyl)methyl-(3-morpholin-4-ium-4-ylpropyl)ammonium CAS Name: (4-ethoxy-3-methoxyphenyl)methyl-[3-(4-morpholin-4-iumyl)propyl]ammonium IUPAC Name: (4-ethoxy-3-methoxyphenyl)methyl-(3-morpholin-4-ium-4-ylpropyl)azanium Traditional Name: (4-ethoxy-3-methoxy-benzyl)-(3-morpholin-4-ium-4-ylpropyl)ammonium Formula: C17H30N2O3+2 MolecularWeight: 310.4317

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C[NH2+]CCC[NH+]2CCOCC2)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C[NH2+]CCC[NH+]2CCOCC2)OC

InChI

InChI=1S/C17H28N2O3/c1-3-22-16-6-5-15(13-17(16)20-2)14-18-7-4-8-19-9-11-21-12-10-19/h5-6,13,18H,3-4,7-12,14H2,1-2H3/p+2