N-[4-[[5,6-bis(oxidanylidene)quinolin-8-yl]amino]pentyl]-4-nitro-benzamide

Systemtic Name: N-[4-[[5,6-bis(oxidanylidene)quinolin-8-yl]amino]pentyl]-4-nitro-benzamide Openeye Name: N-[4-[(5,6-dioxo-8-quinolyl)amino]pentyl]-4-nitro-benzamide CAS Name: N-[4-[(5,6-dioxo-8-quinolinyl)amino]pentyl]-4-nitrobenzamide IUPAC Name: N-[4-[(5,6-dioxoquinolin-8-yl)amino]pentyl]-4-nitrobenzamide Traditional Name: N-[4-[(5,6-diketo-8-quinolyl)amino]pentyl]-4-nitro-benzamide Formula: C21H20N4O5 MolecularWeight: 408.4073

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCCNC(=O)C1=CC=C(C=C1)[N+](=O)[O-])NC2=CC(=O)C(=O)C3=C2N=CC=C3

Isomeric SMILES

CC(CCCNC(=O)C1=CC=C(C=C1)[N+](=O)[O-])NC2=CC(=O)C(=O)C3=C2N=CC=C3

InChI

InChI=1S/C21H20N4O5/c1-13(24-17-12-18(26)20(27)16-5-3-10-22-19(16)17)4-2-11-23-21(28)14-6-8-15(9-7-14)25(29)30/h3,5-10,12-13,24H,2,4,11H2,1H3,(H,23,28)