2-(2-methylpropyl)-4H-isoquinoline-1,3-dione

Systemtic Name: 2-(2-methylpropyl)-4H-isoquinoline-1,3-dione Openeye Name: 2-isobutyl-4H-isoquinoline-1,3-dione CAS Name: 2-(2-methylpropyl)-4H-isoquinoline-1,3-dione IUPAC Name: 2-(2-methylpropyl)-4H-isoquinoline-1,3-dione Traditional Name: 2-isobutyl-4H-isoquinoline-1,3-quinone Formula: C13H15NO2 MolecularWeight: 217.2637

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)CC2=CC=CC=C2C1=O

Isomeric SMILES

CC(C)CN1C(=O)CC2=CC=CC=C2C1=O

InChI

InChI=1S/C13H15NO2/c1-9(2)8-14-12(15)7-10-5-3-4-6-11(10)13(14)16/h3-6,9H,7-8H2,1-2H3