6-[6-morpholin-4-yl-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]hexanoate

Systemtic Name: 6-[6-morpholin-4-yl-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]hexanoate Openeye Name: 6-(6-morpholino-1,3-dioxo-benzo[de]isoquinolin-2-yl)hexanoate CAS Name: 6-[6-(4-morpholinyl)-1,3-dioxo-2-benzo[de]isoquinolinyl]hexanoate IUPAC Name: 6-(6-morpholin-4-yl-1,3-dioxobenzo[de]isoquinolin-2-yl)hexanoate Traditional Name: 6-(1,3-diketo-6-morpholino-benzo[de]isoquinolin-2-yl)hexanoate Formula: C22H23N2O5- MolecularWeight: 395.42842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C3C=CC=C4C3=C(C=C2)C(=O)N(C4=O)CCCCCC(=O)[O-]

Isomeric SMILES

C1COCCN1C2=C3C=CC=C4C3=C(C=C2)C(=O)N(C4=O)CCCCCC(=O)[O-]

InChI

InChI=1S/C22H24N2O5/c25-19(26)7-2-1-3-10-24-21(27)16-6-4-5-15-18(23-11-13-29-14-12-23)9-8-17(20(15)16)22(24)28/h4-6,8-9H,1-3,7,10-14H2,(H,25,26)/p-1