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

Systemtic Name: [4-[(E)-3-thiophen-2-ylprop-2-enoyl]phenyl] 4-bromanylbenzoate Openeye Name: [4-[(E)-3-(2-thienyl)prop-2-enoyl]phenyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [4-[(E)-1-oxo-3-thiophen-2-ylprop-2-enyl]phenyl] ester IUPAC Name: [4-[(E)-3-thiophen-2-ylprop-2-enoyl]phenyl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [4-[(E)-3-(2-thienyl)acryloyl]phenyl] ester Formula: C20H13BrO3S MolecularWeight: 413.28442

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C=CC(=O)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

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

InChI

InChI=1S/C20H13BrO3S/c21-16-7-3-15(4-8-16)20(23)24-17-9-5-14(6-10-17)19(22)12-11-18-2-1-13-25-18/h1-13H/b12-11+