phenacyl (E)-4-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]but-2-enoate

Systemtic Name: phenacyl (E)-4-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]but-2-enoate Openeye Name: phenacyl (E)-4-(1,3-dioxobenzo[de]isoquinolin-2-yl)but-2-enoate CAS Name: (E)-4-(1,3-dioxo-2-benzo[de]isoquinolinyl)-2-butenoic acid phenacyl ester IUPAC Name: phenacyl (E)-4-(1,3-dioxobenzo[de]isoquinolin-2-yl)but-2-enoate Traditional Name: (E)-4-(1,3-diketobenzo[de]isoquinolin-2-yl)but-2-enoic acid phenacyl ester Formula: C24H17NO5 MolecularWeight: 399.39548

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)COC(=O)C=CCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)COC(=O)/C=C/CN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O

InChI

InChI=1S/C24H17NO5/c26-20(16-7-2-1-3-8-16)15-30-21(27)13-6-14-25-23(28)18-11-4-9-17-10-5-12-19(22(17)18)24(25)29/h1-13H,14-15H2/b13-6+