4-methyl-3-[[(1S)-3-oxidanylidene-1H-2-benzofuran-1-yl]amino]benzoate

Systemtic Name: 4-methyl-3-[[(1S)-3-oxidanylidene-1H-2-benzofuran-1-yl]amino]benzoate Openeye Name: 4-methyl-3-[[(1S)-3-oxo-1H-isobenzofuran-1-yl]amino]benzoate CAS Name: 4-methyl-3-[[(1S)-3-oxo-1H-isobenzofuran-1-yl]amino]benzoate IUPAC Name: 4-methyl-3-[[(1S)-3-oxo-1H-2-benzofuran-1-yl]amino]benzoate Traditional Name: 3-[[(1S)-3-ketophthalan-1-yl]amino]-4-methyl-benzoate Formula: C16H12NO4- MolecularWeight: 282.27078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)[O-])NC2C3=CC=CC=C3C(=O)O2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)[O-])N[C@@H]2C3=CC=CC=C3C(=O)O2

InChI

InChI=1S/C16H13NO4/c1-9-6-7-10(15(18)19)8-13(9)17-14-11-4-2-3-5-12(11)16(20)21-14/h2-8,14,17H,1H3,(H,18,19)/p-1/t14-/m0/s1