(1S)-1-cyclohexyl-1-phenyl-5-piperidin-1-ium-1-yl-pent-2-yn-1-ol

Systemtic Name: (1S)-1-cyclohexyl-1-phenyl-5-piperidin-1-ium-1-yl-pent-2-yn-1-ol Openeye Name: (1S)-1-cyclohexyl-1-phenyl-5-piperidin-1-ium-1-yl-pent-2-yn-1-ol CAS Name: (1S)-1-cyclohexyl-1-phenyl-5-(1-piperidin-1-iumyl)-2-pentyn-1-ol IUPAC Name: (1S)-1-cyclohexyl-1-phenyl-5-piperidin-1-ium-1-ylpent-2-yn-1-ol Traditional Name: (1S)-1-cyclohexyl-1-phenyl-5-piperidin-1-ium-1-yl-pent-2-yn-1-ol Formula: C22H32NO+ MolecularWeight: 326.49558

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C#CCC[NH+]2CCCCC2)(C3=CC=CC=C3)O

Isomeric SMILES

C1CCC(CC1)[C@@](C#CCC[NH+]2CCCCC2)(C3=CC=CC=C3)O

InChI

InChI=1S/C22H31NO/c24-22(20-12-4-1-5-13-20,21-14-6-2-7-15-21)16-8-11-19-23-17-9-3-10-18-23/h1,4-5,12-13,21,24H,2-3,6-7,9-11,14-15,17-19H2/p+1/t22-/m1/s1