ethyl 5-[(2-chloranyl-5-nitro-phenyl)sulfonyl-ethanoyl-amino]-2-methyl-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 5-[(2-chloranyl-5-nitro-phenyl)sulfonyl-ethanoyl-amino]-2-methyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 5-[acetyl-(2-chloro-5-nitro-phenyl)sulfonyl-amino]-2-methyl-benzofuran-3-carboxylate CAS Name: 5-[acetyl-(2-chloro-5-nitrophenyl)sulfonylamino]-2-methyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[acetyl-(2-chloro-5-nitrophenyl)sulfonylamino]-2-methyl-1-benzofuran-3-carboxylate Traditional Name: 5-[acetyl-(2-chloro-5-nitro-phenyl)sulfonyl-amino]-2-methyl-benzofuran-3-carboxylic acid ethyl ester Formula: C20H17ClN2O8S MolecularWeight: 480.87558

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C=C(C=C2)N(C(=O)C)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C=C(C=C2)N(C(=O)C)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C20H17ClN2O8S/c1-4-30-20(25)19-11(2)31-17-8-6-13(9-15(17)19)22(12(3)24)32(28,29)18-10-14(23(26)27)5-7-16(18)21/h5-10H,4H2,1-3H3