N-[3-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]propyl]-4-nitro-N-phenyl-benzamide

Systemtic Name: N-[3-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]propyl]-4-nitro-N-phenyl-benzamide Openeye Name: N-[3-(1,3-dioxobenzo[de]isoquinolin-2-yl)propyl]-4-nitro-N-phenyl-benzamide CAS Name: N-[3-(1,3-dioxo-2-benzo[de]isoquinolinyl)propyl]-4-nitro-N-phenylbenzamide IUPAC Name: N-[3-(1,3-dioxobenzo[de]isoquinolin-2-yl)propyl]-4-nitro-N-phenylbenzamide Traditional Name: N-[3-(1,3-diketobenzo[de]isoquinolin-2-yl)propyl]-4-nitro-N-phenyl-benzamide Formula: C28H21N3O5 MolecularWeight: 479.48344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CCCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)C(=O)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N(CCCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)C(=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C28H21N3O5/c32-26(20-13-15-22(16-14-20)31(35)36)29(21-9-2-1-3-10-21)17-6-18-30-27(33)23-11-4-7-19-8-5-12-24(25(19)23)28(30)34/h1-5,7-16H,6,17-18H2