4-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)butanamide

Systemtic Name: 4-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)butanamide Openeye Name: 4-(1,3-dioxobenzo[de]isoquinolin-2-yl)-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)butanamide CAS Name: 4-(1,3-dioxo-2-benzo[de]isoquinolinyl)-N-[2-phenyl-2-(1-pyrrolidinyl)ethyl]butanamide IUPAC Name: 4-(1,3-dioxobenzo[de]isoquinolin-2-yl)-N-(2-phenyl-2-pyrrolidin-1-ylethyl)butanamide Traditional Name: 4-(1,3-diketobenzo[de]isoquinolin-2-yl)-N-(2-phenyl-2-pyrrolidino-ethyl)butyramide Formula: C28H29N3O3 MolecularWeight: 455.54816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)CCCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)C5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)C(CNC(=O)CCCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)C5=CC=CC=C5

InChI

InChI=1S/C28H29N3O3/c32-25(29-19-24(30-16-4-5-17-30)20-9-2-1-3-10-20)15-8-18-31-27(33)22-13-6-11-21-12-7-14-23(26(21)22)28(31)34/h1-3,6-7,9-14,24H,4-5,8,15-19H2,(H,29,32)