3-[4-[4-(4-methoxyphenyl)carbonylpiperazin-1-yl]-3-nitro-phenyl]-4-methyl-4,5-dihydro-1H-pyridazin-6-one

Systemtic Name: 3-[4-[4-(4-methoxyphenyl)carbonylpiperazin-1-yl]-3-nitro-phenyl]-4-methyl-4,5-dihydro-1H-pyridazin-6-one Openeye Name: 3-[4-[4-(4-methoxybenzoyl)piperazin-1-yl]-3-nitro-phenyl]-4-methyl-4,5-dihydro-1H-pyridazin-6-one CAS Name: 3-[4-[4-[(4-methoxyphenyl)-oxomethyl]-1-piperazinyl]-3-nitrophenyl]-4-methyl-4,5-dihydro-1H-pyridazin-6-one IUPAC Name: 3-[4-[4-(4-methoxybenzoyl)piperazin-1-yl]-3-nitrophenyl]-4-methyl-4,5-dihydro-1H-pyridazin-6-one Traditional Name: 4-methyl-3-[3-nitro-4-(4-p-anisoylpiperazino)phenyl]-4,5-dihydro-1H-pyridazin-6-one Formula: C23H25N5O5 MolecularWeight: 451.4751

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NN=C1C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)OC)[N+](=O)[O-]

Isomeric SMILES

CC1CC(=O)NN=C1C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)OC)[N+](=O)[O-]

InChI

InChI=1S/C23H25N5O5/c1-15-13-21(29)24-25-22(15)17-5-8-19(20(14-17)28(31)32)26-9-11-27(12-10-26)23(30)16-3-6-18(33-2)7-4-16/h3-8,14-15H,9-13H2,1-2H3,(H,24,29)