[2-[4-(2-acetamidoethyl)phenyl]-2-oxidanylidene-ethyl] (E)-3-(5-bromanylfuran-2-yl)prop-2-enoate

Systemtic Name: [2-[4-(2-acetamidoethyl)phenyl]-2-oxidanylidene-ethyl] (E)-3-(5-bromanylfuran-2-yl)prop-2-enoate Openeye Name: [2-[4-(2-acetamidoethyl)phenyl]-2-oxo-ethyl] (E)-3-(5-bromo-2-furyl)prop-2-enoate CAS Name: (E)-3-(5-bromo-2-furanyl)-2-propenoic acid [2-[4-(2-acetamidoethyl)phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(2-acetamidoethyl)phenyl]-2-oxoethyl] (E)-3-(5-bromofuran-2-yl)prop-2-enoate Traditional Name: (E)-3-(5-bromo-2-furyl)acrylic acid [2-[4-(2-acetamidoethyl)phenyl]-2-keto-ethyl] ester Formula: C19H18BrNO5 MolecularWeight: 420.25392

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCC1=CC=C(C=C1)C(=O)COC(=O)C=CC2=CC=C(O2)Br

Isomeric SMILES

CC(=O)NCCC1=CC=C(C=C1)C(=O)COC(=O)/C=C/C2=CC=C(O2)Br

InChI

InChI=1S/C19H18BrNO5/c1-13(22)21-11-10-14-2-4-15(5-3-14)17(23)12-25-19(24)9-7-16-6-8-18(20)26-16/h2-9H,10-12H2,1H3,(H,21,22)/b9-7+