methyl 5-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]-2-(methoxymethyl)-1-benzofuran-3-carboxylate

Systemtic Name: methyl 5-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]-2-(methoxymethyl)-1-benzofuran-3-carboxylate Openeye Name: methyl 5-[(4-chloro-3-nitro-phenyl)sulfonylamino]-2-(methoxymethyl)benzofuran-3-carboxylate CAS Name: 5-[(4-chloro-3-nitrophenyl)sulfonylamino]-2-(methoxymethyl)-3-benzofurancarboxylic acid methyl ester IUPAC Name: methyl 5-[(4-chloro-3-nitrophenyl)sulfonylamino]-2-(methoxymethyl)-1-benzofuran-3-carboxylate Traditional Name: 5-[(4-chloro-3-nitro-phenyl)sulfonylamino]-2-(methoxymethyl)benzofuran-3-carboxylic acid methyl ester Formula: C18H15ClN2O8S MolecularWeight: 454.8383

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C(C2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

COCC1=C(C2=C(O1)C=CC(=C2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C18H15ClN2O8S/c1-27-9-16-17(18(22)28-2)12-7-10(3-6-15(12)29-16)20-30(25,26)11-4-5-13(19)14(8-11)21(23)24/h3-8,20H,9H2,1-2H3