(2S)-1-(1-ethynylcyclohexyl)oxy-3-[4-(2-methoxyphenyl)piperazin-1-yl]propan-2-ol

Systemtic Name: (2S)-1-(1-ethynylcyclohexyl)oxy-3-[4-(2-methoxyphenyl)piperazin-1-yl]propan-2-ol Openeye Name: (2S)-1-(1-ethynylcyclohexoxy)-3-[4-(2-methoxyphenyl)piperazin-1-yl]propan-2-ol CAS Name: (2S)-1-(1-ethynylcyclohexyl)oxy-3-[4-(2-methoxyphenyl)-1-piperazinyl]-2-propanol IUPAC Name: (2S)-1-(1-ethynylcyclohexyl)oxy-3-[4-(2-methoxyphenyl)piperazin-1-yl]propan-2-ol Traditional Name: (2S)-1-(1-ethynylcyclohexoxy)-3-[4-(2-methoxyphenyl)piperazino]propan-2-ol Formula: C22H32N2O3 MolecularWeight: 372.50108

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CC(COC3(CCCCC3)C#C)O

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C[C@@H](COC3(CCCCC3)C#C)O

InChI

InChI=1S/C22H32N2O3/c1-3-22(11-7-4-8-12-22)27-18-19(25)17-23-13-15-24(16-14-23)20-9-5-6-10-21(20)26-2/h1,5-6,9-10,19,25H,4,7-8,11-18H2,2H3/t19-/m0/s1