[(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2-(1-methylidene-3-oxidanylidene-isoindol-2-yl)ethanoate

Systemtic Name: [(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2-(1-methylidene-3-oxidanylidene-isoindol-2-yl)ethanoate Openeye Name: [(E)-4-amino-3-cyano-2-oxo-pent-3-enyl] 2-(1-methylene-3-oxo-isoindolin-2-yl)acetate CAS Name: 2-(1-methylene-3-oxo-2-isoindolyl)acetic acid [(E)-4-amino-3-cyano-2-oxopent-3-enyl] ester IUPAC Name: [(E)-4-amino-3-cyano-2-oxopent-3-enyl] 2-(1-methylidene-3-oxoisoindol-2-yl)acetate Traditional Name: 2-(1-keto-3-methylene-isoindolin-2-yl)acetic acid [(E)-4-amino-3-cyano-2-keto-pent-3-enyl] ester Formula: C17H15N3O4 MolecularWeight: 325.3187

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C(=O)COC(=O)CN1C(=C)C2=CC=CC=C2C1=O)N

Isomeric SMILES

C/C(=C(/C#N)\C(=O)COC(=O)CN1C(=C)C2=CC=CC=C2C1=O)/N

InChI

InChI=1S/C17H15N3O4/c1-10(19)14(7-18)15(21)9-24-16(22)8-20-11(2)12-5-3-4-6-13(12)17(20)23/h3-6H,2,8-9,19H2,1H3/b14-10+