7-methyl-5-nitro-6-oxidanyl-1-benzofuran-2-carboxylic acid

Systemtic Name: 7-methyl-5-nitro-6-oxidanyl-1-benzofuran-2-carboxylic acid Openeye Name: 6-hydroxy-7-methyl-5-nitro-benzofuran-2-carboxylic acid CAS Name: 6-hydroxy-7-methyl-5-nitro-2-benzofurancarboxylic acid IUPAC Name: 6-hydroxy-7-methyl-5-nitro-1-benzofuran-2-carboxylic acid Traditional Name: 6-hydroxy-7-methyl-5-nitro-coumarilic acid Formula: C10H7NO6 MolecularWeight: 237.16568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1O)[N+](=O)[O-])C=C(O2)C(=O)O

Isomeric SMILES

CC1=C2C(=CC(=C1O)[N+](=O)[O-])C=C(O2)C(=O)O

InChI

InChI=1S/C10H7NO6/c1-4-8(12)6(11(15)16)2-5-3-7(10(13)14)17-9(4)5/h2-3,12H,1H3,(H,13,14)