ethyl 5-bromanyl-3-[[(E)-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoyl]oxymethyl]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 5-bromanyl-3-[[(E)-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoyl]oxymethyl]-1-benzofuran-2-carboxylate Openeye Name: ethyl 5-bromo-3-[[(E)-3-(2-methylthiazol-4-yl)prop-2-enoyl]oxymethyl]benzofuran-2-carboxylate CAS Name: 5-bromo-3-[[(E)-3-(2-methyl-4-thiazolyl)-1-oxoprop-2-enoxy]methyl]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-bromo-3-[[(E)-3-(2-methyl-1,3-thiazol-4-yl)prop-2-enoyl]oxymethyl]-1-benzofuran-2-carboxylate Traditional Name: 5-bromo-3-[[(E)-3-(2-methylthiazol-4-yl)acryloyl]oxymethyl]coumarilic acid ethyl ester Formula: C19H16BrNO5S MolecularWeight: 450.30304

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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=CSC(=N3)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(O1)C=CC(=C2)Br)COC(=O)/C=C/C3=CSC(=N3)C

InChI

InChI=1S/C19H16BrNO5S/c1-3-24-19(23)18-15(14-8-12(20)4-6-16(14)26-18)9-25-17(22)7-5-13-10-27-11(2)21-13/h4-8,10H,3,9H2,1-2H3/b7-5+