2-cyclohexyl-2-[1-methyl-2-(pyrimidin-2-ylmethyl)cyclohex-2-en-1-yl]-2-oxidanyl-ethanoate

Systemtic Name: 2-cyclohexyl-2-[1-methyl-2-(pyrimidin-2-ylmethyl)cyclohex-2-en-1-yl]-2-oxidanyl-ethanoate Openeye Name: 2-cyclohexyl-2-hydroxy-2-[1-methyl-2-(pyrimidin-2-ylmethyl)cyclohex-2-en-1-yl]acetate CAS Name: 2-cyclohexyl-2-hydroxy-2-[1-methyl-2-(2-pyrimidinylmethyl)-1-cyclohex-2-enyl]acetate IUPAC Name: 2-cyclohexyl-2-hydroxy-2-[1-methyl-2-(pyrimidin-2-ylmethyl)cyclohex-2-en-1-yl]acetate Traditional Name: 2-cyclohexyl-2-hydroxy-2-[1-methyl-2-(2-pyrimidylmethyl)cyclohex-2-en-1-yl]acetate Formula: C20H27N2O3- MolecularWeight: 343.43998

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCC=C1CC2=NC=CC=N2)C(C3CCCCC3)(C(=O)[O-])O

Isomeric SMILES

CC1(CCCC=C1CC2=NC=CC=N2)C(C3CCCCC3)(C(=O)[O-])O

InChI

InChI=1S/C20H28N2O3/c1-19(20(25,18(23)24)15-8-3-2-4-9-15)11-6-5-10-16(19)14-17-21-12-7-13-22-17/h7,10,12-13,15,25H,2-6,8-9,11,14H2,1H3,(H,23,24)/p-1