[4-[6-(3-methoxyphenyl)pyridazin-3-yl]piperazin-1-yl]-(2-nitrophenyl)methanone

Systemtic Name: [4-[6-(3-methoxyphenyl)pyridazin-3-yl]piperazin-1-yl]-(2-nitrophenyl)methanone Openeye Name: [4-[6-(3-methoxyphenyl)pyridazin-3-yl]piperazin-1-yl]-(2-nitrophenyl)methanone CAS Name: [4-[6-(3-methoxyphenyl)-3-pyridazinyl]-1-piperazinyl]-(2-nitrophenyl)methanone IUPAC Name: [4-[6-(3-methoxyphenyl)pyridazin-3-yl]piperazin-1-yl]-(2-nitrophenyl)methanone Traditional Name: [4-[6-(3-methoxyphenyl)pyridazin-3-yl]piperazino]-(2-nitrophenyl)methanone Formula: C22H21N5O4 MolecularWeight: 419.43324

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C22H21N5O4/c1-31-17-6-4-5-16(15-17)19-9-10-21(24-23-19)25-11-13-26(14-12-25)22(28)18-7-2-3-8-20(18)27(29)30/h2-10,15H,11-14H2,1H3