N-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]-4-nitro-benzamide

Systemtic Name: N-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]-4-nitro-benzamide Openeye Name: N-[3-[6-(4-methyl-1-piperidyl)pyridazin-3-yl]phenyl]-4-nitro-benzamide CAS Name: N-[3-[6-(4-methyl-1-piperidinyl)-3-pyridazinyl]phenyl]-4-nitrobenzamide IUPAC Name: N-[3-[6-(4-methylpiperidin-1-yl)pyridazin-3-yl]phenyl]-4-nitrobenzamide Traditional Name: N-[3-[6-(4-methylpiperidino)pyridazin-3-yl]phenyl]-4-nitro-benzamide Formula: C23H23N5O3 MolecularWeight: 417.46042

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=NN=C(C=C2)C3=CC(=CC=C3)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=NN=C(C=C2)C3=CC(=CC=C3)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H23N5O3/c1-16-11-13-27(14-12-16)22-10-9-21(25-26-22)18-3-2-4-19(15-18)24-23(29)17-5-7-20(8-6-17)28(30)31/h2-10,15-16H,11-14H2,1H3,(H,24,29)