[4-chloranyl-2-[(E)-3-thiophen-2-ylprop-2-enoyl]phenyl] 2-bromanylbenzoate

Systemtic Name: [4-chloranyl-2-[(E)-3-thiophen-2-ylprop-2-enoyl]phenyl] 2-bromanylbenzoate Openeye Name: [4-chloro-2-[(E)-3-(2-thienyl)prop-2-enoyl]phenyl] 2-bromobenzoate CAS Name: 2-bromobenzoic acid [4-chloro-2-[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]phenyl] ester IUPAC Name: [4-chloro-2-[(E)-3-thiophen-2-ylprop-2-enoyl]phenyl] 2-bromobenzoate Traditional Name: 2-bromobenzoic acid [4-chloro-2-[(E)-3-(2-thienyl)acryloyl]phenyl] ester Formula: C20H12BrClO3S MolecularWeight: 447.72948

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)OC2=C(C=C(C=C2)Cl)C(=O)C=CC3=CC=CS3)Br

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)OC2=C(C=C(C=C2)Cl)C(=O)/C=C/C3=CC=CS3)Br

InChI

InChI=1S/C20H12BrClO3S/c21-17-6-2-1-5-15(17)20(24)25-19-10-7-13(22)12-16(19)18(23)9-8-14-4-3-11-26-14/h1-12H/b9-8+