4-chloranyl-5-[4-[(5-nitroindazol-1-yl)methyl]piperazin-1-yl]-2-phenyl-pyridazin-3-one

Systemtic Name: 4-chloranyl-5-[4-[(5-nitroindazol-1-yl)methyl]piperazin-1-yl]-2-phenyl-pyridazin-3-one Openeye Name: 4-chloro-5-[4-[(5-nitroindazol-1-yl)methyl]piperazin-1-yl]-2-phenyl-pyridazin-3-one CAS Name: 4-chloro-5-[4-[(5-nitro-1-indazolyl)methyl]-1-piperazinyl]-2-phenyl-3-pyridazinone IUPAC Name: 4-chloro-5-[4-[(5-nitroindazol-1-yl)methyl]piperazin-1-yl]-2-phenylpyridazin-3-one Traditional Name: 4-chloro-5-[4-[(5-nitroindazol-1-yl)methyl]piperazino]-2-phenyl-pyridazin-3-one Formula: C22H20ClN7O3 MolecularWeight: 465.8923

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CN2C3=C(C=C(C=C3)[N+](=O)[O-])C=N2)C4=C(C(=O)N(N=C4)C5=CC=CC=C5)Cl

Isomeric SMILES

C1CN(CCN1CN2C3=C(C=C(C=C3)[N+](=O)[O-])C=N2)C4=C(C(=O)N(N=C4)C5=CC=CC=C5)Cl

InChI

InChI=1S/C22H20ClN7O3/c23-21-20(14-25-29(22(21)31)17-4-2-1-3-5-17)27-10-8-26(9-11-27)15-28-19-7-6-18(30(32)33)12-16(19)13-24-28/h1-7,12-14H,8-11,15H2