2-[1-[(E)-1-cyano-2-ethoxy-2-oxidanyl-ethenyl]-3-oxidanylidene-1H-isoindol-2-yl]ethanoic acid

Systemtic Name: 2-[1-[(E)-1-cyano-2-ethoxy-2-oxidanyl-ethenyl]-3-oxidanylidene-1H-isoindol-2-yl]ethanoic acid Openeye Name: 2-[1-[(E)-1-cyano-2-ethoxy-2-hydroxy-vinyl]-3-oxo-isoindolin-2-yl]acetic acid CAS Name: 2-[1-[(E)-1-cyano-2-ethoxy-2-hydroxyethenyl]-3-oxo-1H-isoindol-2-yl]acetic acid IUPAC Name: 2-[1-[(E)-1-cyano-2-ethoxy-2-hydroxyethenyl]-3-oxo-1H-isoindol-2-yl]acetic acid Traditional Name: 2-[1-[(E)-1-cyano-2-ethoxy-2-hydroxy-vinyl]-3-keto-isoindolin-2-yl]acetic acid Formula: C15H14N2O5 MolecularWeight: 302.28206

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C#N)C1C2=CC=CC=C2C(=O)N1CC(=O)O)O

Isomeric SMILES

CCO/C(=C(/C#N)\C1C2=CC=CC=C2C(=O)N1CC(=O)O)/O

InChI

InChI=1S/C15H14N2O5/c1-2-22-15(21)11(7-16)13-9-5-3-4-6-10(9)14(20)17(13)8-12(18)19/h3-6,13,21H,2,8H2,1H3,(H,18,19)/b15-11-