(2R,3S,4R)-3-ethenyl-2,3-dimethyl-2-(3-oxidanylidenebutyl)-4-(phenylmethoxymethyl)cyclohexan-1-one

Systemtic Name: (2R,3S,4R)-3-ethenyl-2,3-dimethyl-2-(3-oxidanylidenebutyl)-4-(phenylmethoxymethyl)cyclohexan-1-one Openeye Name: (2R,3S,4R)-4-(benzyloxymethyl)-2,3-dimethyl-2-(3-oxobutyl)-3-vinyl-cyclohexanone CAS Name: (2R,3S,4R)-3-ethenyl-2,3-dimethyl-2-(3-oxobutyl)-4-(phenylmethoxymethyl)-1-cyclohexanone IUPAC Name: (2R,3S,4R)-3-ethenyl-2,3-dimethyl-2-(3-oxobutyl)-4-(phenylmethoxymethyl)cyclohexan-1-one Traditional Name: (2R,3S,4R)-4-(benzoxymethyl)-2-(3-ketobutyl)-2,3-dimethyl-3-vinyl-cyclohexanone Formula: C22H30O3 MolecularWeight: 342.4718

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1(C(=O)CCC(C1(C)C=C)COCC2=CC=CC=C2)C

Isomeric SMILES

CC(=O)CC[C@]1(C(=O)CC[C@H]([C@]1(C)C=C)COCC2=CC=CC=C2)C

InChI

InChI=1S/C22H30O3/c1-5-21(3)19(16-25-15-18-9-7-6-8-10-18)11-12-20(24)22(21,4)14-13-17(2)23/h5-10,19H,1,11-16H2,2-4H3/t19-,21-,22-/m0/s1