[4-[2-(3-chlorophenyl)ethynyl]-4-oxidanyl-piperidin-1-yl]-(5-methylpyrazin-2-yl)methanone

Systemtic Name: [4-[2-(3-chlorophenyl)ethynyl]-4-oxidanyl-piperidin-1-yl]-(5-methylpyrazin-2-yl)methanone Openeye Name: [4-[2-(3-chlorophenyl)ethynyl]-4-hydroxy-1-piperidyl]-(5-methylpyrazin-2-yl)methanone CAS Name: [4-[2-(3-chlorophenyl)ethynyl]-4-hydroxy-1-piperidinyl]-(5-methyl-2-pyrazinyl)methanone IUPAC Name: [4-[2-(3-chlorophenyl)ethynyl]-4-hydroxypiperidin-1-yl]-(5-methylpyrazin-2-yl)methanone Traditional Name: [4-[2-(3-chlorophenyl)ethynyl]-4-hydroxy-piperidino]-(5-methylpyrazin-2-yl)methanone Formula: C19H18ClN3O2 MolecularWeight: 355.81812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)N2CCC(CC2)(C#CC3=CC(=CC=C3)Cl)O

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)N2CCC(CC2)(C#CC3=CC(=CC=C3)Cl)O

InChI

InChI=1S/C19H18ClN3O2/c1-14-12-22-17(13-21-14)18(24)23-9-7-19(25,8-10-23)6-5-15-3-2-4-16(20)11-15/h2-4,11-13,25H,7-10H2,1H3