O4-[3-bromanyl-2-[(1E)-buta-1,3-dienyl]phenyl] O1-methyl (E)-but-2-enedioate

Systemtic Name: O4-[3-bromanyl-2-[(1E)-buta-1,3-dienyl]phenyl] O1-methyl (E)-but-2-enedioate Openeye Name: O4-[3-bromo-2-[(1E)-buta-1,3-dienyl]phenyl] O1-methyl (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O4-[3-bromo-2-[(1E)-buta-1,3-dienyl]phenyl] ester O1-methyl ester IUPAC Name: 4-O-[3-bromo-2-[(1E)-buta-1,3-dienyl]phenyl] 1-O-methyl (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O4-[3-bromo-2-[(1E)-buta-1,3-dienyl]phenyl] ester O1-methyl ester Formula: C15H13BrO4 MolecularWeight: 337.16532

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CC(=O)OC1=C(C(=CC=C1)Br)C=CC=C

Isomeric SMILES

COC(=O)/C=C/C(=O)OC1=C(C(=CC=C1)Br)/C=C/C=C

InChI

InChI=1S/C15H13BrO4/c1-3-4-6-11-12(16)7-5-8-13(11)20-15(18)10-9-14(17)19-2/h3-10H,1H2,2H3/b6-4+,10-9+