methyl 3-[[(4-chloranyl-3-nitro-phenyl)amino]methyl]furan-2-carboxylate

Systemtic Name: methyl 3-[[(4-chloranyl-3-nitro-phenyl)amino]methyl]furan-2-carboxylate Openeye Name: methyl 3-[(4-chloro-3-nitro-anilino)methyl]furan-2-carboxylate CAS Name: 3-[(4-chloro-3-nitroanilino)methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 3-[(4-chloro-3-nitroanilino)methyl]furan-2-carboxylate Traditional Name: 3-[(4-chloro-3-nitro-anilino)methyl]furan-2-carboxylic acid methyl ester Formula: C13H11ClN2O5 MolecularWeight: 310.68984

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CO1)CNC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=C(C=CO1)CNC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C13H11ClN2O5/c1-20-13(17)12-8(4-5-21-12)7-15-9-2-3-10(14)11(6-9)16(18)19/h2-6,15H,7H2,1H3