5-bromanyl-3-pyrrol-1-yl-1-benzofuran-2-carboxylate

Systemtic Name: 5-bromanyl-3-pyrrol-1-yl-1-benzofuran-2-carboxylate Openeye Name: 5-bromo-3-pyrrol-1-yl-benzofuran-2-carboxylate CAS Name: 5-bromo-3-(1-pyrrolyl)-2-benzofurancarboxylate IUPAC Name: 5-bromo-3-pyrrol-1-yl-1-benzofuran-2-carboxylate Traditional Name: 5-bromo-3-pyrrol-1-yl-coumarilate Formula: C13H7BrNO3- MolecularWeight: 305.10358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C1)C2=C(OC3=C2C=C(C=C3)Br)C(=O)[O-]

Isomeric SMILES

C1=CN(C=C1)C2=C(OC3=C2C=C(C=C3)Br)C(=O)[O-]

InChI

InChI=1S/C13H8BrNO3/c14-8-3-4-10-9(7-8)11(12(18-10)13(16)17)15-5-1-2-6-15/h1-7H,(H,16,17)/p-1