methyl 4-[3-[4-(3,3-dimethyl-2-oxidanyl-butoxy)-3-methyl-phenyl]pentan-3-yl]-2-methyl-benzoate

Systemtic Name: methyl 4-[3-[4-(3,3-dimethyl-2-oxidanyl-butoxy)-3-methyl-phenyl]pentan-3-yl]-2-methyl-benzoate Openeye Name: methyl 4-[1-ethyl-1-[4-(2-hydroxy-3,3-dimethyl-butoxy)-3-methyl-phenyl]propyl]-2-methyl-benzoate CAS Name: 4-[3-[4-(2-hydroxy-3,3-dimethylbutoxy)-3-methylphenyl]pentan-3-yl]-2-methylbenzoic acid methyl ester IUPAC Name: methyl 4-[3-[4-(2-hydroxy-3,3-dimethylbutoxy)-3-methylphenyl]pentan-3-yl]-2-methylbenzoate Traditional Name: 4-[1-ethyl-1-[4-(2-hydroxy-3,3-dimethyl-butoxy)-3-methyl-phenyl]propyl]-2-methyl-benzoic acid methyl ester Formula: C27H38O4 MolecularWeight: 426.58822

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1=CC(=C(C=C1)C(=O)OC)C)C2=CC(=C(C=C2)OCC(C(C)(C)C)O)C

Isomeric SMILES

CCC(CC)(C1=CC(=C(C=C1)C(=O)OC)C)C2=CC(=C(C=C2)OCC(C(C)(C)C)O)C

InChI

InChI=1S/C27H38O4/c1-9-27(10-2,20-11-13-22(18(3)15-20)25(29)30-8)21-12-14-23(19(4)16-21)31-17-24(28)26(5,6)7/h11-16,24,28H,9-10,17H2,1-8H3