methyl (E)-3-[4-[(3-ethanoyl-2H-imidazol-1-yl)methyl]phenyl]prop-2-enoate bromide

Systemtic Name: methyl (E)-3-[4-[(3-ethanoyl-2H-imidazol-1-yl)methyl]phenyl]prop-2-enoate bromide Openeye Name: methyl (E)-3-[4-[(3-acetyl-2H-imidazol-1-yl)methyl]phenyl]prop-2-enoate bromide CAS Name: (E)-3-[4-[(3-acetyl-2H-imidazol-1-yl)methyl]phenyl]-2-propenoic acid methyl ester bromide IUPAC Name: methyl (E)-3-[4-[(3-acetyl-2H-imidazol-1-yl)methyl]phenyl]prop-2-enoate bromide Traditional Name: (E)-3-[4-[(3-acetyl-4-imidazolin-1-yl)methyl]phenyl]acrylic acid methyl ester bromide Formula: C16H18BrN2O3- MolecularWeight: 366.22972

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CN(C=C1)CC2=CC=C(C=C2)C=CC(=O)OC.[Br-]

Isomeric SMILES

CC(=O)N1CN(C=C1)CC2=CC=C(C=C2)/C=C/C(=O)OC.[Br-]

InChI

InChI=1S/C16H18N2O3.BrH/c1-13(19)18-10-9-17(12-18)11-15-5-3-14(4-6-15)7-8-16(20)21-2;/h3-10H,11-12H2,1-2H3;1H/p-1/b8-7+;