[4-[6-(4-chlorophenyl)pyridazin-3-yl]piperazin-1-yl]-(2-methyl-3-nitro-phenyl)methanone

Systemtic Name: [4-[6-(4-chlorophenyl)pyridazin-3-yl]piperazin-1-yl]-(2-methyl-3-nitro-phenyl)methanone Openeye Name: [4-[6-(4-chlorophenyl)pyridazin-3-yl]piperazin-1-yl]-(2-methyl-3-nitro-phenyl)methanone CAS Name: [4-[6-(4-chlorophenyl)-3-pyridazinyl]-1-piperazinyl]-(2-methyl-3-nitrophenyl)methanone IUPAC Name: [4-[6-(4-chlorophenyl)pyridazin-3-yl]piperazin-1-yl]-(2-methyl-3-nitrophenyl)methanone Traditional Name: [4-[6-(4-chlorophenyl)pyridazin-3-yl]piperazino]-(2-methyl-3-nitro-phenyl)methanone Formula: C22H20ClN5O3 MolecularWeight: 437.8789

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)N2CCN(CC2)C3=NN=C(C=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)N2CCN(CC2)C3=NN=C(C=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H20ClN5O3/c1-15-18(3-2-4-20(15)28(30)31)22(29)27-13-11-26(12-14-27)21-10-9-19(24-25-21)16-5-7-17(23)8-6-16/h2-10H,11-14H2,1H3