(3-bromanyl-5-ethoxy-4-methoxy-phenyl)methyl-(3-morpholin-4-ylpropyl)azanium

Systemtic Name: (3-bromanyl-5-ethoxy-4-methoxy-phenyl)methyl-(3-morpholin-4-ylpropyl)azanium Openeye Name: (3-bromo-5-ethoxy-4-methoxy-phenyl)methyl-(3-morpholinopropyl)ammonium CAS Name: (3-bromo-5-ethoxy-4-methoxyphenyl)methyl-[3-(4-morpholinyl)propyl]ammonium IUPAC Name: (3-bromo-5-ethoxy-4-methoxyphenyl)methyl-(3-morpholin-4-ylpropyl)azanium Traditional Name: (3-bromo-5-ethoxy-4-methoxy-benzyl)-(3-morpholinopropyl)ammonium Formula: C17H28BrN2O3+ MolecularWeight: 388.31982

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C[NH2+]CCCN2CCOCC2)Br)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C[NH2+]CCCN2CCOCC2)Br)OC

InChI

InChI=1S/C17H27BrN2O3/c1-3-23-16-12-14(11-15(18)17(16)21-2)13-19-5-4-6-20-7-9-22-10-8-20/h11-12,19H,3-10,13H2,1-2H3/p+1