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

Systemtic Name: (3-bromanyl-5-methoxy-4-prop-2-enoxy-phenyl)methyl-ethyl-azanium Openeye Name: (4-allyloxy-3-bromo-5-methoxy-phenyl)methyl-ethyl-ammonium CAS Name: (3-bromo-5-methoxy-4-prop-2-enoxyphenyl)methyl-ethylammonium IUPAC Name: (3-bromo-5-methoxy-4-prop-2-enoxyphenyl)methyl-ethylazanium Traditional Name: (4-allyloxy-3-bromo-5-methoxy-benzyl)-ethyl-ammonium Formula: C13H19BrNO2+ MolecularWeight: 301.19946

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18BrNO2/c1-4-6-17-13-11(14)7-10(9-15-5-2)8-12(13)16-3/h4,7-8,15H,1,5-6,9H2,2-3H3/p+1