ethyl 3-[[(Z)-2-acetamido-3-phenyl-prop-2-enoyl]oxymethyl]-5-bromanyl-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-[[(Z)-2-acetamido-3-phenyl-prop-2-enoyl]oxymethyl]-5-bromanyl-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-[[(Z)-2-acetamido-3-phenyl-prop-2-enoyl]oxymethyl]-5-bromo-benzofuran-2-carboxylate CAS Name: 3-[[(Z)-2-acetamido-1-oxo-3-phenylprop-2-enoxy]methyl]-5-bromo-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[(Z)-2-acetamido-3-phenylprop-2-enoyl]oxymethyl]-5-bromo-1-benzofuran-2-carboxylate Traditional Name: 3-[[(Z)-2-acetamido-3-phenyl-acryloyl]oxymethyl]-5-bromo-coumarilic acid ethyl ester Formula: C23H20BrNO6 MolecularWeight: 486.312

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(O1)C=CC(=C2)Br)COC(=O)C(=CC3=CC=CC=C3)NC(=O)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(O1)C=CC(=C2)Br)COC(=O)/C(=C/C3=CC=CC=C3)/NC(=O)C

InChI

InChI=1S/C23H20BrNO6/c1-3-29-23(28)21-18(17-12-16(24)9-10-20(17)31-21)13-30-22(27)19(25-14(2)26)11-15-7-5-4-6-8-15/h4-12H,3,13H2,1-2H3,(H,25,26)/b19-11-