4-(2-azanylpropan-2-yl)-6-chloranyl-2-methyl-5-oxidanyl-1-benzofuran-3-carboxylic acid

Systemtic Name: 4-(2-azanylpropan-2-yl)-6-chloranyl-2-methyl-5-oxidanyl-1-benzofuran-3-carboxylic acid Openeye Name: 4-(1-amino-1-methyl-ethyl)-6-chloro-5-hydroxy-2-methyl-benzofuran-3-carboxylic acid CAS Name: 4-(2-aminopropan-2-yl)-6-chloro-5-hydroxy-2-methyl-3-benzofurancarboxylic acid IUPAC Name: 4-(2-aminopropan-2-yl)-6-chloro-5-hydroxy-2-methyl-1-benzofuran-3-carboxylic acid Traditional Name: 4-(1-amino-1-methyl-ethyl)-6-chloro-5-hydroxy-2-methyl-benzofuran-3-carboxylic acid Formula: C13H14ClNO4 MolecularWeight: 283.70756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C(=C(C=C2O1)Cl)O)C(C)(C)N)C(=O)O

Isomeric SMILES

CC1=C(C2=C(C(=C(C=C2O1)Cl)O)C(C)(C)N)C(=O)O

InChI

InChI=1S/C13H14ClNO4/c1-5-8(12(17)18)9-7(19-5)4-6(14)11(16)10(9)13(2,3)15/h4,16H,15H2,1-3H3,(H,17,18)