methyl (E)-3-[2-[4-(2-methyloctan-2-yl)-2-phenylmethoxy-phenyl]-4-oxidanyl-cyclohexyl]prop-2-enoate

Systemtic Name: methyl (E)-3-[2-[4-(2-methyloctan-2-yl)-2-phenylmethoxy-phenyl]-4-oxidanyl-cyclohexyl]prop-2-enoate Openeye Name: methyl (E)-3-[2-[2-benzyloxy-4-(1,1-dimethylheptyl)phenyl]-4-hydroxy-cyclohexyl]prop-2-enoate CAS Name: (E)-3-[4-hydroxy-2-[4-(2-methyloctan-2-yl)-2-phenylmethoxyphenyl]cyclohexyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-[4-hydroxy-2-[4-(2-methyloctan-2-yl)-2-phenylmethoxyphenyl]cyclohexyl]prop-2-enoate Traditional Name: (E)-3-[2-[2-benzoxy-4-(1,1-dimethylheptyl)phenyl]-4-hydroxy-cyclohexyl]acrylic acid methyl ester Formula: C32H44O4 MolecularWeight: 492.68936

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C)C1=CC(=C(C=C1)C2CC(CCC2C=CC(=O)OC)O)OCC3=CC=CC=C3

Isomeric SMILES

CCCCCCC(C)(C)C1=CC(=C(C=C1)C2CC(CCC2/C=C/C(=O)OC)O)OCC3=CC=CC=C3

InChI

InChI=1S/C32H44O4/c1-5-6-7-11-20-32(2,3)26-16-18-28(30(21-26)36-23-24-12-9-8-10-13-24)29-22-27(33)17-14-25(29)15-19-31(34)35-4/h8-10,12-13,15-16,18-19,21,25,27,29,33H,5-7,11,14,17,20,22-23H2,1-4H3/b19-15+