[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 3-bromanylbenzoate

Systemtic Name: [2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 3-bromanylbenzoate Openeye Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 3-bromobenzoate CAS Name: 3-bromobenzoic acid [2-oxo-2-(1H-pyrrol-2-yl)ethyl] ester IUPAC Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 3-bromobenzoate Traditional Name: 3-bromobenzoic acid [2-keto-2-(1H-pyrrol-2-yl)ethyl] ester Formula: C13H10BrNO3 MolecularWeight: 308.1274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C(=O)OCC(=O)C2=CC=CN2

Isomeric SMILES

C1=CC(=CC(=C1)Br)C(=O)OCC(=O)C2=CC=CN2

InChI

InChI=1S/C13H10BrNO3/c14-10-4-1-3-9(7-10)13(17)18-8-12(16)11-5-2-6-15-11/h1-7,15H,8H2