[4-bromanyl-2-[(E)-3-(2-chlorophenyl)prop-2-enoyl]phenyl] furan-2-carboxylate

Systemtic Name: [4-bromanyl-2-[(E)-3-(2-chlorophenyl)prop-2-enoyl]phenyl] furan-2-carboxylate Openeye Name: [4-bromo-2-[(E)-3-(2-chlorophenyl)prop-2-enoyl]phenyl] furan-2-carboxylate CAS Name: 2-furancarboxylic acid [4-bromo-2-[(E)-3-(2-chlorophenyl)-1-oxoprop-2-enyl]phenyl] ester IUPAC Name: [4-bromo-2-[(E)-3-(2-chlorophenyl)prop-2-enoyl]phenyl] furan-2-carboxylate Traditional Name: furan-2-carboxylic acid [4-bromo-2-[(E)-3-(2-chlorophenyl)acryloyl]phenyl] ester Formula: C20H12BrClO4 MolecularWeight: 431.66388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=CC(=O)C2=C(C=CC(=C2)Br)OC(=O)C3=CC=CO3)Cl

Isomeric SMILES

C1=CC=C(C(=C1)/C=C/C(=O)C2=C(C=CC(=C2)Br)OC(=O)C3=CC=CO3)Cl

InChI

InChI=1S/C20H12BrClO4/c21-14-8-10-18(26-20(24)19-6-3-11-25-19)15(12-14)17(23)9-7-13-4-1-2-5-16(13)22/h1-12H/b9-7+