2-[5-(1,3-benzoxazol-2-yl)-2-methoxy-phenyl]-1,3-bis(oxidanylidene)isoindole-5-carboxylic acid

Systemtic Name: 2-[5-(1,3-benzoxazol-2-yl)-2-methoxy-phenyl]-1,3-bis(oxidanylidene)isoindole-5-carboxylic acid Openeye Name: 2-[5-(1,3-benzoxazol-2-yl)-2-methoxy-phenyl]-1,3-dioxo-isoindoline-5-carboxylic acid CAS Name: 2-[5-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]-1,3-dioxo-5-isoindolecarboxylic acid IUPAC Name: 2-[5-(1,3-benzoxazol-2-yl)-2-methoxyphenyl]-1,3-dioxoisoindole-5-carboxylic acid Traditional Name: 2-[5-(1,3-benzoxazol-2-yl)-2-methoxy-phenyl]-1,3-diketo-isoindoline-5-carboxylic acid Formula: C23H14N2O6 MolecularWeight: 414.36706

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3O2)N4C(=O)C5=C(C4=O)C=C(C=C5)C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3O2)N4C(=O)C5=C(C4=O)C=C(C=C5)C(=O)O

InChI

InChI=1S/C23H14N2O6/c1-30-19-9-7-12(20-24-16-4-2-3-5-18(16)31-20)11-17(19)25-21(26)14-8-6-13(23(28)29)10-15(14)22(25)27/h2-11H,1H3,(H,28,29)