[2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] 2-benzamidobenzoate

Systemtic Name: [2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] 2-benzamidobenzoate Openeye Name: [2-(5-bromo-2-thienyl)-2-oxo-ethyl] 2-benzamidobenzoate CAS Name: 2-benzamidobenzoic acid [2-(5-bromo-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-bromothiophen-2-yl)-2-oxoethyl] 2-benzamidobenzoate Traditional Name: 2-benzamidobenzoic acid [2-(5-bromo-2-thienyl)-2-keto-ethyl] ester Formula: C20H14BrNO4S MolecularWeight: 444.29846

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)OCC(=O)C3=CC=C(S3)Br

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)OCC(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C20H14BrNO4S/c21-18-11-10-17(27-18)16(23)12-26-20(25)14-8-4-5-9-15(14)22-19(24)13-6-2-1-3-7-13/h1-11H,12H2,(H,22,24)