trimethyl-[3-[(E)-3-phenylprop-2-enoyl]oxyphenyl]azanium bromide

Systemtic Name: trimethyl-[3-[(E)-3-phenylprop-2-enoyl]oxyphenyl]azanium bromide Openeye Name: trimethyl-[3-[(E)-3-phenylprop-2-enoyl]oxyphenyl]ammonium bromide CAS Name: trimethyl-[3-[(E)-1-oxo-3-phenylprop-2-enoxy]phenyl]ammonium bromide IUPAC Name: trimethyl-[3-[(E)-3-phenylprop-2-enoyl]oxyphenyl]azanium bromide Traditional Name: trimethyl-[3-[(E)-3-phenylacryloyl]oxyphenyl]ammonium bromide Formula: C18H20BrNO2 MolecularWeight: 362.2609

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C1=CC(=CC=C1)OC(=O)C=CC2=CC=CC=C2.[Br-]

Isomeric SMILES

C[N+](C)(C)C1=CC(=CC=C1)OC(=O)/C=C/C2=CC=CC=C2.[Br-]

InChI

InChI=1S/C18H20NO2.BrH/c1-19(2,3)16-10-7-11-17(14-16)21-18(20)13-12-15-8-5-4-6-9-15;/h4-14H,1-3H3;1H/q+1;/p-1/b13-12+;