5-tert-butyl-2-oxidanyl-benzoic acid; 1-ethyl-3-methyl-benzene

Systemtic Name: 5-tert-butyl-2-oxidanyl-benzoic acid; 1-ethyl-3-methyl-benzene Openeye Name: 5-tert-butyl-2-hydroxy-benzoic acid; 1-ethyl-3-methyl-benzene CAS Name: 5-tert-butyl-2-hydroxybenzoic acid; 1-ethyl-3-methylbenzene IUPAC Name: 5-tert-butyl-2-hydroxybenzoic acid; 1-ethyl-3-methylbenzene Traditional Name: 5-tert-butyl-2-hydroxy-benzoic acid; 1-ethyl-3-methyl-benzene Formula: C20H26O3 MolecularWeight: 314.41864

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1)C.CC(C)(C)C1=CC(=C(C=C1)O)C(=O)O

Isomeric SMILES

CCC1=CC=CC(=C1)C.CC(C)(C)C1=CC(=C(C=C1)O)C(=O)O

InChI

InChI=1S/C11H14O3.C9H12/c1-11(2,3)7-4-5-9(12)8(6-7)10(13)14;1-3-9-6-4-5-8(2)7-9/h4-6,12H,1-3H3,(H,13,14);4-7H,3H2,1-2H3