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

Systemtic Name: [4-[6-(4-methylphenyl)pyridazin-3-yl]piperazin-1-yl]-(4-nitrophenyl)methanone Openeye Name: (4-nitrophenyl)-[4-[6-(p-tolyl)pyridazin-3-yl]piperazin-1-yl]methanone CAS Name: [4-[6-(4-methylphenyl)-3-pyridazinyl]-1-piperazinyl]-(4-nitrophenyl)methanone IUPAC Name: [4-[6-(4-methylphenyl)pyridazin-3-yl]piperazin-1-yl]-(4-nitrophenyl)methanone Traditional Name: (4-nitrophenyl)-[4-[6-(p-tolyl)pyridazin-3-yl]piperazino]methanone Formula: C22H21N5O3 MolecularWeight: 403.43384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(C=C2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(C=C2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H21N5O3/c1-16-2-4-17(5-3-16)20-10-11-21(24-23-20)25-12-14-26(15-13-25)22(28)18-6-8-19(9-7-18)27(29)30/h2-11H,12-15H2,1H3