5-butoxyisoindole-1,3-dione

Systemtic Name: 5-butoxyisoindole-1,3-dione Openeye Name: 5-butoxyisoindoline-1,3-dione CAS Name: 5-butoxyisoindole-1,3-dione IUPAC Name: 5-butoxyisoindole-1,3-dione Traditional Name: 5-butoxyisoindoline-1,3-quinone Formula: C12H13NO3 MolecularWeight: 219.23652

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=C(C=C1)C(=O)NC2=O

Isomeric SMILES

CCCCOC1=CC2=C(C=C1)C(=O)NC2=O

InChI

InChI=1S/C12H13NO3/c1-2-3-6-16-8-4-5-9-10(7-8)12(15)13-11(9)14/h4-5,7H,2-3,6H2,1H3,(H,13,14,15)