ethyl 5-(2-methoxy-5-nitro-phenyl)sulfonyloxy-2-methyl-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 5-(2-methoxy-5-nitro-phenyl)sulfonyloxy-2-methyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 5-(2-methoxy-5-nitro-phenyl)sulfonyloxy-2-methyl-benzofuran-3-carboxylate CAS Name: 5-(2-methoxy-5-nitrophenyl)sulfonyloxy-2-methyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-(2-methoxy-5-nitrophenyl)sulfonyloxy-2-methyl-1-benzofuran-3-carboxylate Traditional Name: 5-(2-methoxy-5-nitro-phenyl)sulfonyloxy-2-methyl-benzofuran-3-carboxylic acid ethyl ester Formula: C19H17NO9S MolecularWeight: 435.40458

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17NO9S/c1-4-27-19(21)18-11(2)28-15-8-6-13(10-14(15)18)29-30(24,25)17-9-12(20(22)23)5-7-16(17)26-3/h5-10H,4H2,1-3H3