4-phenethylisoindole-1,3-dione

Systemtic Name: 4-phenethylisoindole-1,3-dione Openeye Name: 4-phenethylisoindoline-1,3-dione CAS Name: 4-phenethylisoindole-1,3-dione IUPAC Name: 4-phenethylisoindole-1,3-dione Traditional Name: 4-phenethylisoindoline-1,3-quinone Formula: C16H13NO2 MolecularWeight: 251.27992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=CC=CC3=C2C(=O)NC3=O

Isomeric SMILES

C1=CC=C(C=C1)CCC2=CC=CC3=C2C(=O)NC3=O

InChI

InChI=1S/C16H13NO2/c18-15-13-8-4-7-12(14(13)16(19)17-15)10-9-11-5-2-1-3-6-11/h1-8H,9-10H2,(H,17,18,19)