[4-[2-(1-oxidanylcyclohexyl)ethynyl]phenyl]-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: [4-[2-(1-oxidanylcyclohexyl)ethynyl]phenyl]-(4-phenylpiperazin-1-yl)methanone Openeye Name: [4-[2-(1-hydroxycyclohexyl)ethynyl]phenyl]-(4-phenylpiperazin-1-yl)methanone CAS Name: [4-[2-(1-hydroxycyclohexyl)ethynyl]phenyl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: [4-[2-(1-hydroxycyclohexyl)ethynyl]phenyl]-(4-phenylpiperazin-1-yl)methanone Traditional Name: [4-[2-(1-hydroxycyclohexyl)ethynyl]phenyl]-(4-phenylpiperazino)methanone Formula: C25H28N2O2 MolecularWeight: 388.50202

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C#CC2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4)O

Isomeric SMILES

C1CCC(CC1)(C#CC2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4)O

InChI

InChI=1S/C25H28N2O2/c28-24(27-19-17-26(18-20-27)23-7-3-1-4-8-23)22-11-9-21(10-12-22)13-16-25(29)14-5-2-6-15-25/h1,3-4,7-12,29H,2,5-6,14-15,17-20H2