6-[[[1-(3-chloranyl-4-fluoranyl-phenyl)carbonyl-4-fluoranyl-piperidin-4-yl]methylamino]methyl]pyridine-3-carbonitrile

Systemtic Name: 6-[[[1-(3-chloranyl-4-fluoranyl-phenyl)carbonyl-4-fluoranyl-piperidin-4-yl]methylamino]methyl]pyridine-3-carbonitrile Openeye Name: 6-[[[1-(3-chloro-4-fluoro-benzoyl)-4-fluoro-4-piperidyl]methylamino]methyl]pyridine-3-carbonitrile CAS Name: 6-[[[1-[(3-chloro-4-fluorophenyl)-oxomethyl]-4-fluoro-4-piperidinyl]methylamino]methyl]-3-pyridinecarbonitrile IUPAC Name: 6-[[[1-(3-chloro-4-fluorobenzoyl)-4-fluoropiperidin-4-yl]methylamino]methyl]pyridine-3-carbonitrile Traditional Name: 6-[[[1-(3-chloro-4-fluoro-benzoyl)-4-fluoro-4-piperidyl]methylamino]methyl]nicotinonitrile Formula: C20H19ClF2N4O MolecularWeight: 404.840866

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(CNCC2=NC=C(C=C2)C#N)F)C(=O)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1CN(CCC1(CNCC2=NC=C(C=C2)C#N)F)C(=O)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C20H19ClF2N4O/c21-17-9-15(2-4-18(17)22)19(28)27-7-5-20(23,6-8-27)13-25-12-16-3-1-14(10-24)11-26-16/h1-4,9,11,25H,5-8,12-13H2