5-[[(1S)-3-oxidanylidene-1H-2-benzofuran-1-yl]amino]benzene-1,3-dicarboxylate

Systemtic Name: 5-[[(1S)-3-oxidanylidene-1H-2-benzofuran-1-yl]amino]benzene-1,3-dicarboxylate Openeye Name: 5-[[(1S)-3-oxo-1H-isobenzofuran-1-yl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[(1S)-3-oxo-1H-isobenzofuran-1-yl]amino]benzene-1,3-dicarboxylate IUPAC Name: 5-[[(1S)-3-oxo-1H-2-benzofuran-1-yl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[(1S)-3-ketophthalan-1-yl]amino]isophthalate Formula: C16H9NO6-2 MolecularWeight: 311.24576

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(OC2=O)NC3=CC(=CC(=C3)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)[C@H](OC2=O)NC3=CC(=CC(=C3)C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C16H11NO6/c18-14(19)8-5-9(15(20)21)7-10(6-8)17-13-11-3-1-2-4-12(11)16(22)23-13/h1-7,13,17H,(H,18,19)(H,20,21)/p-2/t13-/m0/s1