1-[3-(2,2-dimethylpropanoyloxy)prop-1-en-2-yl]-4-phenylmethoxy-cyclohexane-1-carboxylic acid

Systemtic Name: 1-[3-(2,2-dimethylpropanoyloxy)prop-1-en-2-yl]-4-phenylmethoxy-cyclohexane-1-carboxylic acid Openeye Name: 4-benzyloxy-1-[1-(2,2-dimethylpropanoyloxymethyl)vinyl]cyclohexanecarboxylic acid CAS Name: 1-[3-(2,2-dimethyl-1-oxopropoxy)prop-1-en-2-yl]-4-phenylmethoxy-1-cyclohexanecarboxylic acid IUPAC Name: 1-[3-(2,2-dimethylpropanoyloxy)prop-1-en-2-yl]-4-phenylmethoxycyclohexane-1-carboxylic acid Traditional Name: 4-benzoxy-1-[1-(pivaloyloxymethyl)vinyl]cyclohexanecarboxylic acid Formula: C22H30O5 MolecularWeight: 374.4706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCC(=C)C1(CCC(CC1)OCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C)(C)C(=O)OCC(=C)C1(CCC(CC1)OCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C22H30O5/c1-16(14-27-20(25)21(2,3)4)22(19(23)24)12-10-18(11-13-22)26-15-17-8-6-5-7-9-17/h5-9,18H,1,10-15H2,2-4H3,(H,23,24)