N-(6-chloranyl-4-methyl-pyridazin-3-yl)-1-[3-(trifluoromethyl)phenyl]piperidine-4-carboxamide

Systemtic Name: N-(6-chloranyl-4-methyl-pyridazin-3-yl)-1-[3-(trifluoromethyl)phenyl]piperidine-4-carboxamide Openeye Name: N-(6-chloro-4-methyl-pyridazin-3-yl)-1-[3-(trifluoromethyl)phenyl]piperidine-4-carboxamide CAS Name: N-(6-chloro-4-methyl-3-pyridazinyl)-1-[3-(trifluoromethyl)phenyl]-4-piperidinecarboxamide IUPAC Name: N-(6-chloro-4-methylpyridazin-3-yl)-1-[3-(trifluoromethyl)phenyl]piperidine-4-carboxamide Traditional Name: N-(6-chloro-4-methyl-pyridazin-3-yl)-1-[3-(trifluoromethyl)phenyl]isonipecotamide Formula: C18H18ClF3N4O MolecularWeight: 398.80993

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN=C1NC(=O)C2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F)Cl

Isomeric SMILES

CC1=CC(=NN=C1NC(=O)C2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F)Cl

InChI

InChI=1S/C18H18ClF3N4O/c1-11-9-15(19)24-25-16(11)23-17(27)12-5-7-26(8-6-12)14-4-2-3-13(10-14)18(20,21)22/h2-4,9-10,12H,5-8H2,1H3,(H,23,25,27)