methyl 5-[[2-(2-hydroxyethylamino)-5-nitro-phenyl]carbonyloxymethyl]-3-methyl-furan-2-carboxylate

Systemtic Name: methyl 5-[[2-(2-hydroxyethylamino)-5-nitro-phenyl]carbonyloxymethyl]-3-methyl-furan-2-carboxylate Openeye Name: methyl 5-[[2-(2-hydroxyethylamino)-5-nitro-benzoyl]oxymethyl]-3-methyl-furan-2-carboxylate CAS Name: 5-[[[2-(2-hydroxyethylamino)-5-nitrophenyl]-oxomethoxy]methyl]-3-methyl-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[2-(2-hydroxyethylamino)-5-nitrobenzoyl]oxymethyl]-3-methylfuran-2-carboxylate Traditional Name: 5-[[2-(2-hydroxyethylamino)-5-nitro-benzoyl]oxymethyl]-3-methyl-furan-2-carboxylic acid methyl ester Formula: C17H18N2O8 MolecularWeight: 378.33342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1)COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCCO)C(=O)OC

Isomeric SMILES

CC1=C(OC(=C1)COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCCO)C(=O)OC

InChI

InChI=1S/C17H18N2O8/c1-10-7-12(27-15(10)17(22)25-2)9-26-16(21)13-8-11(19(23)24)3-4-14(13)18-5-6-20/h3-4,7-8,18,20H,5-6,9H2,1-2H3