3-nitro-N-[4-(6-piperidin-1-ylpyridazin-3-yl)phenyl]benzamide

Systemtic Name: 3-nitro-N-[4-(6-piperidin-1-ylpyridazin-3-yl)phenyl]benzamide Openeye Name: 3-nitro-N-[4-[6-(1-piperidyl)pyridazin-3-yl]phenyl]benzamide CAS Name: 3-nitro-N-[4-[6-(1-piperidinyl)-3-pyridazinyl]phenyl]benzamide IUPAC Name: 3-nitro-N-[4-(6-piperidin-1-ylpyridazin-3-yl)phenyl]benzamide Traditional Name: 3-nitro-N-[4-(6-piperidinopyridazin-3-yl)phenyl]benzamide Formula: C22H21N5O3 MolecularWeight: 403.43384

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NN=C(C=C2)C3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=NN=C(C=C2)C3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H21N5O3/c28-22(17-5-4-6-19(15-17)27(29)30)23-18-9-7-16(8-10-18)20-11-12-21(25-24-20)26-13-2-1-3-14-26/h4-12,15H,1-3,13-14H2,(H,23,28)