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

Systemtic Name: [4-(6-cyclohexyloxypyridazin-3-yl)piperazin-1-yl]-(3-nitrophenyl)methanone Openeye Name: [4-[6-(cyclohexoxy)pyridazin-3-yl]piperazin-1-yl]-(3-nitrophenyl)methanone CAS Name: [4-(6-cyclohexyloxy-3-pyridazinyl)-1-piperazinyl]-(3-nitrophenyl)methanone IUPAC Name: [4-(6-cyclohexyloxypyridazin-3-yl)piperazin-1-yl]-(3-nitrophenyl)methanone Traditional Name: [4-[6-(cyclohexoxy)pyridazin-3-yl]piperazino]-(3-nitrophenyl)methanone Formula: C21H25N5O4 MolecularWeight: 411.4543

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC2=NN=C(C=C2)N3CCN(CC3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)OC2=NN=C(C=C2)N3CCN(CC3)C(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H25N5O4/c27-21(16-5-4-6-17(15-16)26(28)29)25-13-11-24(12-14-25)19-9-10-20(23-22-19)30-18-7-2-1-3-8-18/h4-6,9-10,15,18H,1-3,7-8,11-14H2