3-butoxy-3-phenyl-2H-isoquinoline-1,4-dione

Systemtic Name: 3-butoxy-3-phenyl-2H-isoquinoline-1,4-dione Openeye Name: 3-butoxy-3-phenyl-2H-isoquinoline-1,4-dione CAS Name: 3-butoxy-3-phenyl-2H-isoquinoline-1,4-dione IUPAC Name: 3-butoxy-3-phenyl-2H-isoquinoline-1,4-dione Traditional Name: 3-butoxy-3-phenyl-2H-isoquinoline-1,4-quinone Formula: C19H19NO3 MolecularWeight: 309.35906

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1(C(=O)C2=CC=CC=C2C(=O)N1)C3=CC=CC=C3

Isomeric SMILES

CCCCOC1(C(=O)C2=CC=CC=C2C(=O)N1)C3=CC=CC=C3

InChI

InChI=1S/C19H19NO3/c1-2-3-13-23-19(14-9-5-4-6-10-14)17(21)15-11-7-8-12-16(15)18(22)20-19/h4-12H,2-3,13H2,1H3,(H,20,22)