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

Systemtic Name: (3-bromanyl-4-ethoxy-5-methoxy-phenyl)methyl-prop-2-enyl-azanium Openeye Name: allyl-[(3-bromo-4-ethoxy-5-methoxy-phenyl)methyl]ammonium CAS Name: (3-bromo-4-ethoxy-5-methoxyphenyl)methyl-prop-2-enylammonium IUPAC Name: (3-bromo-4-ethoxy-5-methoxyphenyl)methyl-prop-2-enylazanium Traditional Name: allyl-(3-bromo-4-ethoxy-5-methoxy-benzyl)ammonium Formula: C13H19BrNO2+ MolecularWeight: 301.19946

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C[NH2+]CC=C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C[NH2+]CC=C)OC

InChI

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