pentyl 4-[(5-bromanyl-1-benzofuran-2-yl)carbonylamino]benzoate

Systemtic Name: pentyl 4-[(5-bromanyl-1-benzofuran-2-yl)carbonylamino]benzoate Openeye Name: pentyl 4-[(5-bromobenzofuran-2-carbonyl)amino]benzoate CAS Name: 4-[[(5-bromo-2-benzofuranyl)-oxomethyl]amino]benzoic acid pentyl ester IUPAC Name: pentyl 4-[(5-bromo-1-benzofuran-2-carbonyl)amino]benzoate Traditional Name: 4-[(5-bromobenzofuran-2-carbonyl)amino]benzoic acid amyl ester Formula: C21H20BrNO4 MolecularWeight: 430.2918

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC3=C(O2)C=CC(=C3)Br

Isomeric SMILES

CCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC3=C(O2)C=CC(=C3)Br

InChI

InChI=1S/C21H20BrNO4/c1-2-3-4-11-26-21(25)14-5-8-17(9-6-14)23-20(24)19-13-15-12-16(22)7-10-18(15)27-19/h5-10,12-13H,2-4,11H2,1H3,(H,23,24)