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

Systemtic Name: (3-chloranyl-4-ethoxy-phenyl)methyl-(3-morpholin-4-ium-4-ylpropyl)azanium Openeye Name: (3-chloro-4-ethoxy-phenyl)methyl-(3-morpholin-4-ium-4-ylpropyl)ammonium CAS Name: (3-chloro-4-ethoxyphenyl)methyl-[3-(4-morpholin-4-iumyl)propyl]ammonium IUPAC Name: (3-chloro-4-ethoxyphenyl)methyl-(3-morpholin-4-ium-4-ylpropyl)azanium Traditional Name: (3-chloro-4-ethoxy-benzyl)-(3-morpholin-4-ium-4-ylpropyl)ammonium Formula: C16H27ClN2O2+2 MolecularWeight: 314.85078

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25ClN2O2/c1-2-21-16-5-4-14(12-15(16)17)13-18-6-3-7-19-8-10-20-11-9-19/h4-5,12,18H,2-3,6-11,13H2,1H3/p+2