(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methyl-[3-(2-methoxyethoxy)propyl]azanium

Systemtic Name: (3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methyl-[3-(2-methoxyethoxy)propyl]azanium Openeye Name: (3-bromo-4-hydroxy-5-methoxy-phenyl)methyl-[3-(2-methoxyethoxy)propyl]ammonium CAS Name: (3-bromo-4-hydroxy-5-methoxyphenyl)methyl-[3-(2-methoxyethoxy)propyl]ammonium IUPAC Name: (3-bromo-4-hydroxy-5-methoxyphenyl)methyl-[3-(2-methoxyethoxy)propyl]azanium Traditional Name: (3-bromo-4-hydroxy-5-methoxy-benzyl)-[3-(2-methoxyethoxy)propyl]ammonium Formula: C14H23BrNO4+ MolecularWeight: 349.24072

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Descriptors Computed from Structure

Canonical SMILES:

COCCOCCC[NH2+]CC1=CC(=C(C(=C1)Br)O)OC

Isomeric SMILES

COCCOCCC[NH2+]CC1=CC(=C(C(=C1)Br)O)OC

InChI

InChI=1S/C14H22BrNO4/c1-18-6-7-20-5-3-4-16-10-11-8-12(15)14(17)13(9-11)19-2/h8-9,16-17H,3-7,10H2,1-2H3/p+1