ethyl 5-[(3-nitrophenyl)sulfonylamino]-2-propyl-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 5-[(3-nitrophenyl)sulfonylamino]-2-propyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 5-[(3-nitrophenyl)sulfonylamino]-2-propyl-benzofuran-3-carboxylate CAS Name: 5-[(3-nitrophenyl)sulfonylamino]-2-propyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(3-nitrophenyl)sulfonylamino]-2-propyl-1-benzofuran-3-carboxylate Traditional Name: 5-[(3-nitrophenyl)sulfonylamino]-2-propyl-benzofuran-3-carboxylic acid ethyl ester Formula: C20H20N2O7S MolecularWeight: 432.447

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCCC1=C(C2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C20H20N2O7S/c1-3-6-18-19(20(23)28-4-2)16-11-13(9-10-17(16)29-18)21-30(26,27)15-8-5-7-14(12-15)22(24)25/h5,7-12,21H,3-4,6H2,1-2H3