(3-bromanyl-5-methoxy-4-prop-2-enoxy-phenyl)methyl-(3-ethoxypropyl)azanium

Systemtic Name: (3-bromanyl-5-methoxy-4-prop-2-enoxy-phenyl)methyl-(3-ethoxypropyl)azanium Openeye Name: (4-allyloxy-3-bromo-5-methoxy-phenyl)methyl-(3-ethoxypropyl)ammonium CAS Name: (3-bromo-5-methoxy-4-prop-2-enoxyphenyl)methyl-(3-ethoxypropyl)ammonium IUPAC Name: (3-bromo-5-methoxy-4-prop-2-enoxyphenyl)methyl-(3-ethoxypropyl)azanium Traditional Name: (4-allyloxy-3-bromo-5-methoxy-benzyl)-(3-ethoxypropyl)ammonium Formula: C16H25BrNO3+ MolecularWeight: 359.2786

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCC[NH2+]CC1=CC(=C(C(=C1)Br)OCC=C)OC

Isomeric SMILES

CCOCCC[NH2+]CC1=CC(=C(C(=C1)Br)OCC=C)OC

InChI

InChI=1S/C16H24BrNO3/c1-4-8-21-16-14(17)10-13(11-15(16)19-3)12-18-7-6-9-20-5-2/h4,10-11,18H,1,5-9,12H2,2-3H3/p+1