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

Systemtic Name: ethyl 5-[(2-chloranyl-5-nitro-phenyl)sulfonylamino]-2-methyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 5-[(2-chloro-5-nitro-phenyl)sulfonylamino]-2-methyl-benzofuran-3-carboxylate CAS Name: 5-[(2-chloro-5-nitrophenyl)sulfonylamino]-2-methyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(2-chloro-5-nitrophenyl)sulfonylamino]-2-methyl-1-benzofuran-3-carboxylate Traditional Name: 5-[(2-chloro-5-nitro-phenyl)sulfonylamino]-2-methyl-benzofuran-3-carboxylic acid ethyl ester Formula: C18H15ClN2O7S MolecularWeight: 438.8389

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15ClN2O7S/c1-3-27-18(22)17-10(2)28-15-7-4-11(8-13(15)17)20-29(25,26)16-9-12(21(23)24)5-6-14(16)19/h4-9,20H,3H2,1-2H3