N-[4-[2-(3-chlorophenyl)ethynyl]-4-oxidanyl-cyclohexyl]pyridine-3-carboxamide

Systemtic Name: N-[4-[2-(3-chlorophenyl)ethynyl]-4-oxidanyl-cyclohexyl]pyridine-3-carboxamide Openeye Name: N-[4-[2-(3-chlorophenyl)ethynyl]-4-hydroxy-cyclohexyl]pyridine-3-carboxamide CAS Name: N-[4-[2-(3-chlorophenyl)ethynyl]-4-hydroxycyclohexyl]-3-pyridinecarboxamide IUPAC Name: N-[4-[2-(3-chlorophenyl)ethynyl]-4-hydroxycyclohexyl]pyridine-3-carboxamide Traditional Name: N-[4-[2-(3-chlorophenyl)ethynyl]-4-hydroxy-cyclohexyl]nicotinamide Formula: C20H19ClN2O2 MolecularWeight: 354.83006

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NC(=O)C2=CN=CC=C2)(C#CC3=CC(=CC=C3)Cl)O

Isomeric SMILES

C1CC(CCC1NC(=O)C2=CN=CC=C2)(C#CC3=CC(=CC=C3)Cl)O

InChI

InChI=1S/C20H19ClN2O2/c21-17-5-1-3-15(13-17)6-9-20(25)10-7-18(8-11-20)23-19(24)16-4-2-12-22-14-16/h1-5,12-14,18,25H,7-8,10-11H2,(H,23,24)