(4-nitrophenyl)-[4-(6-phenylazanylpyridazin-3-yl)piperazin-1-yl]methanone

Systemtic Name: (4-nitrophenyl)-[4-(6-phenylazanylpyridazin-3-yl)piperazin-1-yl]methanone Openeye Name: [4-(6-anilinopyridazin-3-yl)piperazin-1-yl]-(4-nitrophenyl)methanone CAS Name: [4-(6-anilino-3-pyridazinyl)-1-piperazinyl]-(4-nitrophenyl)methanone IUPAC Name: [4-(6-anilinopyridazin-3-yl)piperazin-1-yl]-(4-nitrophenyl)methanone Traditional Name: [4-(6-anilinopyridazin-3-yl)piperazino]-(4-nitrophenyl)methanone Formula: C21H20N6O3 MolecularWeight: 404.4219

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NN=C(C=C2)NC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=NN=C(C=C2)NC3=CC=CC=C3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H20N6O3/c28-21(16-6-8-18(9-7-16)27(29)30)26-14-12-25(13-15-26)20-11-10-19(23-24-20)22-17-4-2-1-3-5-17/h1-11H,12-15H2,(H,22,23)