(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methyl-prop-2-enyl-azanium

Systemtic Name: (3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methyl-prop-2-enyl-azanium Openeye Name: allyl-[(3-bromo-4-hydroxy-5-methoxy-phenyl)methyl]ammonium CAS Name: (3-bromo-4-hydroxy-5-methoxyphenyl)methyl-prop-2-enylammonium IUPAC Name: (3-bromo-4-hydroxy-5-methoxyphenyl)methyl-prop-2-enylazanium Traditional Name: allyl-(3-bromo-4-hydroxy-5-methoxy-benzyl)ammonium Formula: C11H15BrNO2+ MolecularWeight: 273.1463

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C[NH2+]CC=C)Br)O

Isomeric SMILES

COC1=C(C(=CC(=C1)C[NH2+]CC=C)Br)O

InChI

InChI=1S/C11H14BrNO2/c1-3-4-13-7-8-5-9(12)11(14)10(6-8)15-2/h3,5-6,13-14H,1,4,7H2,2H3/p+1