2-ethynyl-4-(3-methoxypyrrolidin-1-yl)-1-methyl-2-pyridin-3-yl-piperidine-3,3-diol

Systemtic Name: 2-ethynyl-4-(3-methoxypyrrolidin-1-yl)-1-methyl-2-pyridin-3-yl-piperidine-3,3-diol Openeye Name: 2-ethynyl-4-(3-methoxypyrrolidin-1-yl)-1-methyl-2-(3-pyridyl)piperidine-3,3-diol CAS Name: 2-ethynyl-4-(3-methoxy-1-pyrrolidinyl)-1-methyl-2-(3-pyridinyl)piperidine-3,3-diol IUPAC Name: 2-ethynyl-4-(3-methoxypyrrolidin-1-yl)-1-methyl-2-pyridin-3-ylpiperidine-3,3-diol Traditional Name: 2-ethynyl-4-(3-methoxypyrrolidino)-1-methyl-2-(3-pyridyl)piperidine-3,3-diol Formula: C18H25N3O3 MolecularWeight: 331.4094

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(C(C1(C#C)C2=CN=CC=C2)(O)O)N3CCC(C3)OC

Isomeric SMILES

CN1CCC(C(C1(C#C)C2=CN=CC=C2)(O)O)N3CCC(C3)OC

InChI

InChI=1S/C18H25N3O3/c1-4-17(14-6-5-9-19-12-14)18(22,23)16(8-10-20(17)2)21-11-7-15(13-21)24-3/h1,5-6,9,12,15-16,22-23H,7-8,10-11,13H2,2-3H3