2-ethynyl-6-[[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl]oxymethyl]pyridine

Systemtic Name: 2-ethynyl-6-[[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl]oxymethyl]pyridine Openeye Name: 2-ethynyl-6-[[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexoxy]methyl]pyridine CAS Name: 2-ethynyl-6-[[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxymethyl]pyridine IUPAC Name: 2-ethynyl-6-[[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxymethyl]pyridine Traditional Name: 2-ethynyl-6-[[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexoxy]methyl]pyridine Formula: C18H25NO MolecularWeight: 271.3972

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OCC2=CC=CC(=N2)C#C)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)OCC2=CC=CC(=N2)C#C)C(C)C

InChI

InChI=1S/C18H25NO/c1-5-15-7-6-8-16(19-15)12-20-18-11-14(4)9-10-17(18)13(2)3/h1,6-8,13-14,17-18H,9-12H2,2-4H3/t14-,17+,18-/m1/s1