2-hexyl-7-methylidene-4,7a-dihydro-3aH-isoindole-1,3-dione

Systemtic Name: 2-hexyl-7-methylidene-4,7a-dihydro-3aH-isoindole-1,3-dione Openeye Name: 2-hexyl-7-methylene-4,7a-dihydro-3aH-isoindole-1,3-dione CAS Name: 2-hexyl-7-methylene-4,7a-dihydro-3aH-isoindole-1,3-dione IUPAC Name: 2-hexyl-7-methylidene-4,7a-dihydro-3aH-isoindole-1,3-dione Traditional Name: 2-hexyl-7-methylene-4,7a-dihydro-3aH-isoindole-1,3-quinone Formula: C15H21NO2 MolecularWeight: 247.33274

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2CC=CC(=C)C2C1=O

Isomeric SMILES

CCCCCCN1C(=O)C2CC=CC(=C)C2C1=O

InChI

InChI=1S/C15H21NO2/c1-3-4-5-6-10-16-14(17)12-9-7-8-11(2)13(12)15(16)18/h7-8,12-13H,2-6,9-10H2,1H3