methyl 2-[[3-[(4-tert-butylcyclohexyl)methoxy]phenoxy]methyl]-6-methyl-benzoate

Systemtic Name: methyl 2-[[3-[(4-tert-butylcyclohexyl)methoxy]phenoxy]methyl]-6-methyl-benzoate Openeye Name: methyl 2-[[3-[(4-tert-butylcyclohexyl)methoxy]phenoxy]methyl]-6-methyl-benzoate CAS Name: 2-[[3-[(4-tert-butylcyclohexyl)methoxy]phenoxy]methyl]-6-methylbenzoic acid methyl ester IUPAC Name: methyl 2-[[3-[(4-tert-butylcyclohexyl)methoxy]phenoxy]methyl]-6-methylbenzoate Traditional Name: 2-[[3-[(4-tert-butylcyclohexyl)methoxy]phenoxy]methyl]-6-methyl-benzoic acid methyl ester Formula: C27H36O4 MolecularWeight: 424.57234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)COC2=CC(=CC=C2)OCC3CCC(CC3)C(C)(C)C)C(=O)OC

Isomeric SMILES

CC1=C(C(=CC=C1)COC2=CC(=CC=C2)OCC3CCC(CC3)C(C)(C)C)C(=O)OC

InChI

InChI=1S/C27H36O4/c1-19-8-6-9-21(25(19)26(28)29-5)18-31-24-11-7-10-23(16-24)30-17-20-12-14-22(15-13-20)27(2,3)4/h6-11,16,20,22H,12-15,17-18H2,1-5H3