(2-oxidanylideneoxolan-3-yl) 3-azanyl-4-methyl-benzoate

Systemtic Name: (2-oxidanylideneoxolan-3-yl) 3-azanyl-4-methyl-benzoate Openeye Name: (2-oxotetrahydrofuran-3-yl) 3-amino-4-methyl-benzoate CAS Name: 3-amino-4-methylbenzoic acid (2-oxo-3-oxolanyl) ester IUPAC Name: (2-oxooxolan-3-yl) 3-amino-4-methylbenzoate Traditional Name: 3-amino-4-methyl-benzoic acid (2-ketotetrahydrofuran-3-yl) ester Formula: C12H13NO4 MolecularWeight: 235.23592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC2CCOC2=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC2CCOC2=O)N

InChI

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