5-methyl-2-[(2-oxidanylideneoxolan-3-yl)amino]benzoic acid

Systemtic Name: 5-methyl-2-[(2-oxidanylideneoxolan-3-yl)amino]benzoic acid Openeye Name: 5-methyl-2-[(2-oxotetrahydrofuran-3-yl)amino]benzoic acid CAS Name: 5-methyl-2-[(2-oxo-3-oxolanyl)amino]benzoic acid IUPAC Name: 5-methyl-2-[(2-oxooxolan-3-yl)amino]benzoic acid Traditional Name: 2-[(2-ketotetrahydrofuran-3-yl)amino]-5-methyl-benzoic acid Formula: C12H13NO4 MolecularWeight: 235.23592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2CCOC2=O)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)NC2CCOC2=O)C(=O)O

InChI

InChI=1S/C12H13NO4/c1-7-2-3-9(8(6-7)11(14)15)13-10-4-5-17-12(10)16/h2-3,6,10,13H,4-5H2,1H3,(H,14,15)