(1-methyl-5,6-dihydro-4H-pyrimidin-2-yl)methyl 2-cyclohexyl-2-oxidanyl-2-phenyl-ethanoate chloride

Systemtic Name: (1-methyl-5,6-dihydro-4H-pyrimidin-2-yl)methyl 2-cyclohexyl-2-oxidanyl-2-phenyl-ethanoate chloride Openeye Name: (1-methyl-5,6-dihydro-4H-pyrimidin-2-yl)methyl 2-cyclohexyl-2-hydroxy-2-phenyl-acetate chloride CAS Name: 2-cyclohexyl-2-hydroxy-2-phenylacetic acid (1-methyl-5,6-dihydro-4H-pyrimidin-2-yl)methyl ester chloride IUPAC Name: (1-methyl-5,6-dihydro-4H-pyrimidin-2-yl)methyl 2-cyclohexyl-2-hydroxy-2-phenylacetate chloride Traditional Name: 2-cyclohexyl-2-hydroxy-2-phenyl-acetic acid (1-methyl-5,6-dihydro-4H-pyrimidin-2-yl)methyl ester chloride Formula: C20H28ClN2O3- MolecularWeight: 379.90092

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN=C1COC(=O)C(C2CCCCC2)(C3=CC=CC=C3)O.[Cl-]

Isomeric SMILES

CN1CCCN=C1COC(=O)C(C2CCCCC2)(C3=CC=CC=C3)O.[Cl-]

InChI

InChI=1S/C20H28N2O3.ClH/c1-22-14-8-13-21-18(22)15-25-19(23)20(24,16-9-4-2-5-10-16)17-11-6-3-7-12-17;/h2,4-5,9-10,17,24H,3,6-8,11-15H2,1H3;1H/p-1