[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 3-[2-methoxy-3-(phenylmethoxymethyl)pyridin-4-yl]-3-oxidanyl-pentanoate

Systemtic Name: [(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl] 3-[2-methoxy-3-(phenylmethoxymethyl)pyridin-4-yl]-3-oxidanyl-pentanoate Openeye Name: [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] 3-[3-(benzyloxymethyl)-2-methoxy-4-pyridyl]-3-hydroxy-pentanoate CAS Name: 3-hydroxy-3-[2-methoxy-3-(phenylmethoxymethyl)-4-pyridinyl]pentanoic acid [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] ester IUPAC Name: [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] 3-hydroxy-3-[2-methoxy-3-(phenylmethoxymethyl)pyridin-4-yl]pentanoate Traditional Name: 3-[3-(benzoxymethyl)-2-methoxy-4-pyridyl]-3-hydroxy-valeric acid [(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl] ester Formula: C29H41NO5 MolecularWeight: 483.63954

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=O)OC1CC(CCC1C(C)C)C)(C2=C(C(=NC=C2)OC)COCC3=CC=CC=C3)O

Isomeric SMILES

CCC(CC(=O)O[C@@H]1C[C@@H](CC[C@H]1C(C)C)C)(C2=C(C(=NC=C2)OC)COCC3=CC=CC=C3)O

InChI

InChI=1S/C29H41NO5/c1-6-29(32,17-27(31)35-26-16-21(4)12-13-23(26)20(2)3)25-14-15-30-28(33-5)24(25)19-34-18-22-10-8-7-9-11-22/h7-11,14-15,20-21,23,26,32H,6,12-13,16-19H2,1-5H3/t21-,23+,26-,29?/m1/s1