5-butan-2-yl-3-hexan-2-yl-2-oxidanyl-benzoic acid

Systemtic Name: 5-butan-2-yl-3-hexan-2-yl-2-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-3-(1-methylpentyl)-5-sec-butyl-benzoic acid CAS Name: 5-butan-2-yl-3-hexan-2-yl-2-hydroxybenzoic acid IUPAC Name: 5-butan-2-yl-3-hexan-2-yl-2-hydroxybenzoic acid Traditional Name: 2-hydroxy-3-(1-methylpentyl)-5-sec-butyl-benzoic acid Formula: C17H26O3 MolecularWeight: 278.38654

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)C1=C(C(=CC(=C1)C(C)CC)C(=O)O)O

Isomeric SMILES

CCCCC(C)C1=C(C(=CC(=C1)C(C)CC)C(=O)O)O

InChI

InChI=1S/C17H26O3/c1-5-7-8-12(4)14-9-13(11(3)6-2)10-15(16(14)18)17(19)20/h9-12,18H,5-8H2,1-4H3,(H,19,20)