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

Systemtic Name: 5-(2-chloranyl-4-nitro-phenyl)-2-methyl-furan-3-carboxylic acid Openeye Name: 5-(2-chloro-4-nitro-phenyl)-2-methyl-furan-3-carboxylic acid CAS Name: 5-(2-chloro-4-nitrophenyl)-2-methyl-3-furancarboxylic acid IUPAC Name: 5-(2-chloro-4-nitrophenyl)-2-methylfuran-3-carboxylic acid Traditional Name: 5-(2-chloro-4-nitro-phenyl)-2-methyl-3-furoic acid Formula: C12H8ClNO5 MolecularWeight: 281.64862

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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