[1,3-bis(oxidanylidene)benzo[de]isoquinolin-4-yl] hexanoate

Systemtic Name: [1,3-bis(oxidanylidene)benzo[de]isoquinolin-4-yl] hexanoate Openeye Name: (1,3-dioxobenzo[de]isoquinolin-4-yl) hexanoate CAS Name: hexanoic acid (1,3-dioxo-4-benzo[de]isoquinolinyl) ester IUPAC Name: (1,3-dioxobenzo[de]isoquinolin-4-yl) hexanoate Traditional Name: hexanoic acid (1,3-diketobenzo[de]isoquinolin-4-yl) ester Formula: C18H17NO4 MolecularWeight: 311.33188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OC1=C2C3=C(C=CC=C3C(=O)NC2=O)C=C1

Isomeric SMILES

CCCCCC(=O)OC1=C2C3=C(C=CC=C3C(=O)NC2=O)C=C1

InChI

InChI=1S/C18H17NO4/c1-2-3-4-8-14(20)23-13-10-9-11-6-5-7-12-15(11)16(13)18(22)19-17(12)21/h5-7,9-10H,2-4,8H2,1H3,(H,19,21,22)