tert-butyl 5-oxidanyl-4-(2,3,4-trimethylphenyl)pentanoate

Systemtic Name: tert-butyl 5-oxidanyl-4-(2,3,4-trimethylphenyl)pentanoate Openeye Name: tert-butyl 5-hydroxy-4-(2,3,4-trimethylphenyl)pentanoate CAS Name: 5-hydroxy-4-(2,3,4-trimethylphenyl)pentanoic acid tert-butyl ester IUPAC Name: tert-butyl 5-hydroxy-4-(2,3,4-trimethylphenyl)pentanoate Traditional Name: 5-hydroxy-4-(2,3,4-trimethylphenyl)valeric acid tert-butyl ester Formula: C18H28O3 MolecularWeight: 292.41312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C(CCC(=O)OC(C)(C)C)CO)C)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C(CCC(=O)OC(C)(C)C)CO)C)C

InChI

InChI=1S/C18H28O3/c1-12-7-9-16(14(3)13(12)2)15(11-19)8-10-17(20)21-18(4,5)6/h7,9,15,19H,8,10-11H2,1-6H3