5-(4-chloranyl-2-nitro-phenyl)-2-methyl-furan-3-carboxylate

Systemtic Name: 5-(4-chloranyl-2-nitro-phenyl)-2-methyl-furan-3-carboxylate Openeye Name: 5-(4-chloro-2-nitro-phenyl)-2-methyl-furan-3-carboxylate CAS Name: 5-(4-chloro-2-nitrophenyl)-2-methyl-3-furancarboxylate IUPAC Name: 5-(4-chloro-2-nitrophenyl)-2-methylfuran-3-carboxylate Traditional Name: 5-(4-chloro-2-nitro-phenyl)-2-methyl-3-furoate Formula: C12H7ClNO5- MolecularWeight: 280.64068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C2=C(C=C(C=C2)Cl)[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

CC1=C(C=C(O1)C2=C(C=C(C=C2)Cl)[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C12H8ClNO5/c1-6-9(12(15)16)5-11(19-6)8-3-2-7(13)4-10(8)14(17)18/h2-5H,1H3,(H,15,16)/p-1