methyl 4-chloranyl-2-[(5-nitrofuran-2-yl)methylamino]benzoate

Systemtic Name: methyl 4-chloranyl-2-[(5-nitrofuran-2-yl)methylamino]benzoate Openeye Name: methyl 4-chloro-2-[(5-nitro-2-furyl)methylamino]benzoate CAS Name: 4-chloro-2-[(5-nitro-2-furanyl)methylamino]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-2-[(5-nitrofuran-2-yl)methylamino]benzoate Traditional Name: 4-chloro-2-[(5-nitro-2-furyl)methylamino]benzoic acid methyl ester Formula: C13H11ClN2O5 MolecularWeight: 310.68984

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C=C1)Cl)NCC2=CC=C(O2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=C(C=C(C=C1)Cl)NCC2=CC=C(O2)[N+](=O)[O-]

InChI

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