methyl 5-(2-methylheptan-2-yl)-2-oxidanyl-benzoate

Systemtic Name: methyl 5-(2-methylheptan-2-yl)-2-oxidanyl-benzoate Openeye Name: methyl 5-(1,1-dimethylhexyl)-2-hydroxy-benzoate CAS Name: 2-hydroxy-5-(2-methylheptan-2-yl)benzoic acid methyl ester IUPAC Name: methyl 2-hydroxy-5-(2-methylheptan-2-yl)benzoate Traditional Name: 5-(1,1-dimethylhexyl)-2-hydroxy-benzoic acid methyl ester Formula: C16H24O3 MolecularWeight: 264.35996

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)(C)C1=CC(=C(C=C1)O)C(=O)OC

Isomeric SMILES

CCCCCC(C)(C)C1=CC(=C(C=C1)O)C(=O)OC

InChI

InChI=1S/C16H24O3/c1-5-6-7-10-16(2,3)12-8-9-14(17)13(11-12)15(18)19-4/h8-9,11,17H,5-7,10H2,1-4H3