tert-butyl 2-[2-[(6-cyclohexyl-3-methyl-1-oxidanyl-cyclohexa-2,4-dien-1-yl)methyl]phenoxy]ethanoate

Systemtic Name: tert-butyl 2-[2-[(6-cyclohexyl-3-methyl-1-oxidanyl-cyclohexa-2,4-dien-1-yl)methyl]phenoxy]ethanoate Openeye Name: tert-butyl 2-[2-[(6-cyclohexyl-1-hydroxy-3-methyl-cyclohexa-2,4-dien-1-yl)methyl]phenoxy]acetate CAS Name: 2-[2-[(6-cyclohexyl-1-hydroxy-3-methyl-1-cyclohexa-2,4-dienyl)methyl]phenoxy]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[2-[(6-cyclohexyl-1-hydroxy-3-methylcyclohexa-2,4-dien-1-yl)methyl]phenoxy]acetate Traditional Name: 2-[2-[(6-cyclohexyl-1-hydroxy-3-methyl-cyclohexa-2,4-dien-1-yl)methyl]phenoxy]acetic acid tert-butyl ester Formula: C26H36O4 MolecularWeight: 412.56164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(C(C=C1)C2CCCCC2)(CC3=CC=CC=C3OCC(=O)OC(C)(C)C)O

Isomeric SMILES

CC1=CC(C(C=C1)C2CCCCC2)(CC3=CC=CC=C3OCC(=O)OC(C)(C)C)O

InChI

InChI=1S/C26H36O4/c1-19-14-15-22(20-10-6-5-7-11-20)26(28,16-19)17-21-12-8-9-13-23(21)29-18-24(27)30-25(2,3)4/h8-9,12-16,20,22,28H,5-7,10-11,17-18H2,1-4H3