3-azanyl-4,6,7-trimethyl-5-oxidanyl-1-benzofuran-2-carboxylic acid

Systemtic Name: 3-azanyl-4,6,7-trimethyl-5-oxidanyl-1-benzofuran-2-carboxylic acid Openeye Name: 3-amino-5-hydroxy-4,6,7-trimethyl-benzofuran-2-carboxylic acid CAS Name: 3-amino-5-hydroxy-4,6,7-trimethyl-2-benzofurancarboxylic acid IUPAC Name: 3-amino-5-hydroxy-4,6,7-trimethyl-1-benzofuran-2-carboxylic acid Traditional Name: 3-amino-5-hydroxy-4,6,7-trimethyl-coumarilic acid Formula: C12H13NO4 MolecularWeight: 235.23592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C(=C(OC2=C1C)C(=O)O)N)C)O

Isomeric SMILES

CC1=C(C(=C2C(=C(OC2=C1C)C(=O)O)N)C)O

InChI

InChI=1S/C12H13NO4/c1-4-5(2)10-7(6(3)9(4)14)8(13)11(17-10)12(15)16/h14H,13H2,1-3H3,(H,15,16)