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

Systemtic Name: [4-[6-(4-methoxyphenyl)pyridazin-3-yl]piperazin-1-yl]-(2-methyl-3-nitro-phenyl)methanone Openeye Name: [4-[6-(4-methoxyphenyl)pyridazin-3-yl]piperazin-1-yl]-(2-methyl-3-nitro-phenyl)methanone CAS Name: [4-[6-(4-methoxyphenyl)-3-pyridazinyl]-1-piperazinyl]-(2-methyl-3-nitrophenyl)methanone IUPAC Name: [4-[6-(4-methoxyphenyl)pyridazin-3-yl]piperazin-1-yl]-(2-methyl-3-nitrophenyl)methanone Traditional Name: [4-[6-(4-methoxyphenyl)pyridazin-3-yl]piperazino]-(2-methyl-3-nitro-phenyl)methanone Formula: C23H23N5O4 MolecularWeight: 433.45982

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C23H23N5O4/c1-16-19(4-3-5-21(16)28(30)31)23(29)27-14-12-26(13-15-27)22-11-10-20(24-25-22)17-6-8-18(32-2)9-7-17/h3-11H,12-15H2,1-2H3