(2Z)-2-cyano-2-[3-(2-ethoxy-2-oxidanylidene-ethyl)-2,3-dihydroisoindol-1-ylidene]ethanoic acid

Systemtic Name: (2Z)-2-cyano-2-[3-(2-ethoxy-2-oxidanylidene-ethyl)-2,3-dihydroisoindol-1-ylidene]ethanoic acid Openeye Name: (2Z)-2-cyano-2-[3-(2-ethoxy-2-oxo-ethyl)isoindolin-1-ylidene]acetic acid CAS Name: (2Z)-2-cyano-2-[3-(2-ethoxy-2-oxoethyl)-2,3-dihydroisoindol-1-ylidene]acetic acid IUPAC Name: (2Z)-2-cyano-2-[3-(2-ethoxy-2-oxoethyl)-2,3-dihydroisoindol-1-ylidene]acetic acid Traditional Name: (2Z)-2-cyano-2-[3-(2-ethoxy-2-keto-ethyl)isoindolin-1-ylidene]acetic acid Formula: C15H14N2O4 MolecularWeight: 286.28266

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1C2=CC=CC=C2C(=C(C#N)C(=O)O)N1

Isomeric SMILES

CCOC(=O)CC1C2=CC=CC=C2/C(=C(\C#N)/C(=O)O)/N1

InChI

InChI=1S/C15H14N2O4/c1-2-21-13(18)7-12-9-5-3-4-6-10(9)14(17-12)11(8-16)15(19)20/h3-6,12,17H,2,7H2,1H3,(H,19,20)/b14-11-