4-butan-2-yl-2-methyl-benzoic acid

Systemtic Name: 4-butan-2-yl-2-methyl-benzoic acid Openeye Name: 2-methyl-4-sec-butyl-benzoic acid CAS Name: 4-butan-2-yl-2-methylbenzoic acid IUPAC Name: 4-butan-2-yl-2-methylbenzoic acid Traditional Name: 2-methyl-4-sec-butyl-benzoic acid Formula: C12H16O2 MolecularWeight: 192.25424

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC(=C(C=C1)C(=O)O)C

Isomeric SMILES

CCC(C)C1=CC(=C(C=C1)C(=O)O)C

InChI

InChI=1S/C12H16O2/c1-4-8(2)10-5-6-11(12(13)14)9(3)7-10/h5-8H,4H2,1-3H3,(H,13,14)