methyl (1R,6R)-2-oxidanylidene-6-[(1R)-1-phenylmethoxyethyl]-1-prop-2-ynyl-cyclohex-3-ene-1-carboxylate

Systemtic Name: methyl (1R,6R)-2-oxidanylidene-6-[(1R)-1-phenylmethoxyethyl]-1-prop-2-ynyl-cyclohex-3-ene-1-carboxylate Openeye Name: methyl (1R,6R)-6-[(1R)-1-benzyloxyethyl]-2-oxo-1-prop-2-ynyl-cyclohex-3-ene-1-carboxylate CAS Name: (1R,6R)-2-oxo-6-[(1R)-1-phenylmethoxyethyl]-1-prop-2-ynyl-1-cyclohex-3-enecarboxylic acid methyl ester IUPAC Name: methyl (1R,6R)-2-oxo-6-[(1R)-1-phenylmethoxyethyl]-1-prop-2-ynylcyclohex-3-ene-1-carboxylate Traditional Name: (1R,6R)-6-[(1R)-1-benzoxyethyl]-2-keto-1-propargyl-cyclohex-3-ene-1-carboxylic acid methyl ester Formula: C20H22O4 MolecularWeight: 326.38628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC=CC(=O)C1(CC#C)C(=O)OC)OCC2=CC=CC=C2

Isomeric SMILES

C[C@H]([C@@H]1CC=CC(=O)[C@]1(CC#C)C(=O)OC)OCC2=CC=CC=C2

InChI

InChI=1S/C20H22O4/c1-4-13-20(19(22)23-3)17(11-8-12-18(20)21)15(2)24-14-16-9-6-5-7-10-16/h1,5-10,12,15,17H,11,13-14H2,2-3H3/t15-,17+,20-/m1/s1