2-tert-butyl-3-phenyl-3H-isoquinoline-1,4-dione

Systemtic Name: 2-tert-butyl-3-phenyl-3H-isoquinoline-1,4-dione Openeye Name: 2-tert-butyl-3-phenyl-3H-isoquinoline-1,4-dione CAS Name: 2-tert-butyl-3-phenyl-3H-isoquinoline-1,4-dione IUPAC Name: 2-tert-butyl-3-phenyl-3H-isoquinoline-1,4-dione Traditional Name: 2-tert-butyl-3-phenyl-3H-isoquinoline-1,4-quinone Formula: C19H19NO2 MolecularWeight: 293.35966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(C(=O)C2=CC=CC=C2C1=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)N1C(C(=O)C2=CC=CC=C2C1=O)C3=CC=CC=C3

InChI

InChI=1S/C19H19NO2/c1-19(2,3)20-16(13-9-5-4-6-10-13)17(21)14-11-7-8-12-15(14)18(20)22/h4-12,16H,1-3H3