5-ethanoyl-2-[4-[(E)-3-oxidanylidenebut-1-enyl]phenyl]isoindole-1,3-dione

Systemtic Name: 5-ethanoyl-2-[4-[(E)-3-oxidanylidenebut-1-enyl]phenyl]isoindole-1,3-dione Openeye Name: 5-acetyl-2-[4-[(E)-3-oxobut-1-enyl]phenyl]isoindoline-1,3-dione CAS Name: 5-acetyl-2-[4-[(E)-3-oxobut-1-enyl]phenyl]isoindole-1,3-dione IUPAC Name: 5-acetyl-2-[4-[(E)-3-oxobut-1-enyl]phenyl]isoindole-1,3-dione Traditional Name: 5-acetyl-2-[4-[(E)-3-ketobut-1-enyl]phenyl]isoindoline-1,3-quinone Formula: C20H15NO4 MolecularWeight: 333.3374

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C=CC1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)C

Isomeric SMILES

CC(=O)/C=C/C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)C

InChI

InChI=1S/C20H15NO4/c1-12(22)3-4-14-5-8-16(9-6-14)21-19(24)17-10-7-15(13(2)23)11-18(17)20(21)25/h3-11H,1-2H3/b4-3+