ethyl pentanoate; 2-oxidanylisoindole-1,3-dione

Systemtic Name: ethyl pentanoate; 2-oxidanylisoindole-1,3-dione Openeye Name: ethyl pentanoate; 2-hydroxyisoindoline-1,3-dione CAS Name: 2-hydroxyisoindole-1,3-dione; pentanoic acid ethyl ester IUPAC Name: ethyl pentanoate; 2-hydroxyisoindole-1,3-dione Traditional Name: 2-hydroxyisoindoline-1,3-quinone; valeric acid ethyl ester Formula: C15H19NO5 MolecularWeight: 293.31506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OCC.C1=CC=C2C(=C1)C(=O)N(C2=O)O

Isomeric SMILES

CCCCC(=O)OCC.C1=CC=C2C(=C1)C(=O)N(C2=O)O

InChI

InChI=1S/C8H5NO3.C7H14O2/c10-7-5-3-1-2-4-6(5)8(11)9(7)12;1-3-5-6-7(8)9-4-2/h1-4,12H;3-6H2,1-2H3