(2-bromanyl-4,5-dimethoxy-phenyl)methyl (E)-3-quinolin-8-ylprop-2-enoate

Systemtic Name: (2-bromanyl-4,5-dimethoxy-phenyl)methyl (E)-3-quinolin-8-ylprop-2-enoate Openeye Name: (2-bromo-4,5-dimethoxy-phenyl)methyl (E)-3-(8-quinolyl)prop-2-enoate CAS Name: (E)-3-(8-quinolinyl)-2-propenoic acid (2-bromo-4,5-dimethoxyphenyl)methyl ester IUPAC Name: (2-bromo-4,5-dimethoxyphenyl)methyl (E)-3-quinolin-8-ylprop-2-enoate Traditional Name: (E)-3-(8-quinolyl)acrylic acid (2-bromo-4,5-dimethoxy-benzyl) ester Formula: C21H18BrNO4 MolecularWeight: 428.27592

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)COC(=O)C=CC2=CC=CC3=C2N=CC=C3)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)COC(=O)/C=C/C2=CC=CC3=C2N=CC=C3)Br)OC

InChI

InChI=1S/C21H18BrNO4/c1-25-18-11-16(17(22)12-19(18)26-2)13-27-20(24)9-8-15-6-3-5-14-7-4-10-23-21(14)15/h3-12H,13H2,1-2H3/b9-8+