3-[1-azanyl-2-(3-methoxypyrrolidin-1-yl)-1-oxidanyl-2-pyridin-3-yl-ethyl]-3-ethynyl-cyclohexan-1-ol

Systemtic Name: 3-[1-azanyl-2-(3-methoxypyrrolidin-1-yl)-1-oxidanyl-2-pyridin-3-yl-ethyl]-3-ethynyl-cyclohexan-1-ol Openeye Name: 3-[1-amino-1-hydroxy-2-(3-methoxypyrrolidin-1-yl)-2-(3-pyridyl)ethyl]-3-ethynyl-cyclohexanol CAS Name: 3-[1-amino-1-hydroxy-2-(3-methoxy-1-pyrrolidinyl)-2-(3-pyridinyl)ethyl]-3-ethynyl-1-cyclohexanol IUPAC Name: 3-[1-amino-1-hydroxy-2-(3-methoxypyrrolidin-1-yl)-2-pyridin-3-ylethyl]-3-ethynylcyclohexan-1-ol Traditional Name: 3-[1-amino-1-hydroxy-2-(3-methoxypyrrolidino)-2-(3-pyridyl)ethyl]-3-ethynyl-cyclohexanol Formula: C20H29N3O3 MolecularWeight: 359.46256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1CCN(C1)C(C2=CN=CC=C2)C(C3(CCCC(C3)O)C#C)(N)O

Isomeric SMILES

COC1CCN(C1)C(C2=CN=CC=C2)C(C3(CCCC(C3)O)C#C)(N)O

InChI

InChI=1S/C20H29N3O3/c1-3-19(9-4-7-16(24)12-19)20(21,25)18(15-6-5-10-22-13-15)23-11-8-17(14-23)26-2/h1,5-6,10,13,16-18,24-25H,4,7-9,11-12,14,21H2,2H3