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

Systemtic Name: 5-(2-methyl-4-nitro-phenyl)furan-2-carboxylic acid Openeye Name: 5-(2-methyl-4-nitro-phenyl)furan-2-carboxylic acid CAS Name: 5-(2-methyl-4-nitrophenyl)-2-furancarboxylic acid IUPAC Name: 5-(2-methyl-4-nitrophenyl)furan-2-carboxylic acid Traditional Name: 5-(2-methyl-4-nitro-phenyl)-2-furoic acid Formula: C12H9NO5 MolecularWeight: 247.20356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])C2=CC=C(O2)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])C2=CC=C(O2)C(=O)O

InChI

InChI=1S/C12H9NO5/c1-7-6-8(13(16)17)2-3-9(7)10-4-5-11(18-10)12(14)15/h2-6H,1H3,(H,14,15)