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

Systemtic Name: (3-bromanyl-5-methoxy-4-prop-2-enoxy-phenyl)methyl-(2-methoxyethyl)azanium Openeye Name: (4-allyloxy-3-bromo-5-methoxy-phenyl)methyl-(2-methoxyethyl)ammonium CAS Name: (3-bromo-5-methoxy-4-prop-2-enoxyphenyl)methyl-(2-methoxyethyl)ammonium IUPAC Name: (3-bromo-5-methoxy-4-prop-2-enoxyphenyl)methyl-(2-methoxyethyl)azanium Traditional Name: (4-allyloxy-3-bromo-5-methoxy-benzyl)-(2-methoxyethyl)ammonium Formula: C14H21BrNO3+ MolecularWeight: 331.22544

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20BrNO3/c1-4-6-19-14-12(15)8-11(9-13(14)18-3)10-16-5-7-17-2/h4,8-9,16H,1,5-7,10H2,2-3H3/p+1