(2S)-2-(4-butan-2-ylphenyl)propanoic acid

Systemtic Name: (2S)-2-(4-butan-2-ylphenyl)propanoic acid Openeye Name: (2S)-2-(4-sec-butylphenyl)propanoic acid CAS Name: (2S)-2-(4-butan-2-ylphenyl)propanoic acid IUPAC Name: (2S)-2-(4-butan-2-ylphenyl)propanoic acid Traditional Name: (2S)-2-(4-sec-butylphenyl)propionic acid Formula: C13H18O2 MolecularWeight: 206.28082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)[C@H](C)C(=O)O

InChI

InChI=1S/C13H18O2/c1-4-9(2)11-5-7-12(8-6-11)10(3)13(14)15/h5-10H,4H2,1-3H3,(H,14,15)/t9?,10-/m0/s1