2-ethylhexyl (2Z)-2-cyano-2-(3-oxidanylideneisoindol-1-ylidene)ethanoate

Systemtic Name: 2-ethylhexyl (2Z)-2-cyano-2-(3-oxidanylideneisoindol-1-ylidene)ethanoate Openeye Name: 2-ethylhexyl (2Z)-2-cyano-2-(3-oxoisoindolin-1-ylidene)acetate CAS Name: (2Z)-2-cyano-2-(3-oxo-1-isoindolylidene)acetic acid 2-ethylhexyl ester IUPAC Name: 2-ethylhexyl (2Z)-2-cyano-2-(3-oxoisoindol-1-ylidene)acetate Traditional Name: (2Z)-2-cyano-2-(3-ketoisoindolin-1-ylidene)acetic acid 2-ethylhexyl ester Formula: C19H22N2O3 MolecularWeight: 326.38958

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)C(=C1C2=CC=CC=C2C(=O)N1)C#N

Isomeric SMILES

CCCCC(CC)COC(=O)/C(=C\1/C2=CC=CC=C2C(=O)N1)/C#N

InChI

InChI=1S/C19H22N2O3/c1-3-5-8-13(4-2)12-24-19(23)16(11-20)17-14-9-6-7-10-15(14)18(22)21-17/h6-7,9-10,13H,3-5,8,12H2,1-2H3,(H,21,22)/b17-16-