methyl 5-[[(2-nitro-4-oxidanyl-phenyl)amino]methyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[(2-nitro-4-oxidanyl-phenyl)amino]methyl]furan-2-carboxylate Openeye Name: methyl 5-[(4-hydroxy-2-nitro-anilino)methyl]furan-2-carboxylate CAS Name: 5-[(4-hydroxy-2-nitroanilino)methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(4-hydroxy-2-nitroanilino)methyl]furan-2-carboxylate Traditional Name: 5-[(4-hydroxy-2-nitro-anilino)methyl]furan-2-carboxylic acid methyl ester Formula: C13H12N2O6 MolecularWeight: 292.24418

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)CNC2=C(C=C(C=C2)O)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=C(O1)CNC2=C(C=C(C=C2)O)[N+](=O)[O-]

InChI

InChI=1S/C13H12N2O6/c1-20-13(17)12-5-3-9(21-12)7-14-10-4-2-8(16)6-11(10)15(18)19/h2-6,14,16H,7H2,1H3