(3-chloranyl-4,5-dimethoxy-phenyl)methyl-(3-morpholin-4-ium-4-ylpropyl)azanium

Systemtic Name: (3-chloranyl-4,5-dimethoxy-phenyl)methyl-(3-morpholin-4-ium-4-ylpropyl)azanium Openeye Name: (3-chloro-4,5-dimethoxy-phenyl)methyl-(3-morpholin-4-ium-4-ylpropyl)ammonium CAS Name: (3-chloro-4,5-dimethoxyphenyl)methyl-[3-(4-morpholin-4-iumyl)propyl]ammonium IUPAC Name: (3-chloro-4,5-dimethoxyphenyl)methyl-(3-morpholin-4-ium-4-ylpropyl)azanium Traditional Name: (3-chloro-4,5-dimethoxy-benzyl)-(3-morpholin-4-ium-4-ylpropyl)ammonium Formula: C16H27ClN2O3+2 MolecularWeight: 330.85018

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25ClN2O3/c1-20-15-11-13(10-14(17)16(15)21-2)12-18-4-3-5-19-6-8-22-9-7-19/h10-11,18H,3-9,12H2,1-2H3/p+2