2-acetyloxy-5-[(2S)-butan-2-yl]benzoic acid

Systemtic Name: 2-acetyloxy-5-[(2S)-butan-2-yl]benzoic acid Openeye Name: 2-acetoxy-5-[(1S)-1-methylpropyl]benzoic acid CAS Name: 2-acetyloxy-5-[(2S)-butan-2-yl]benzoic acid IUPAC Name: 2-acetyloxy-5-[(2S)-butan-2-yl]benzoic acid Traditional Name: 2-acetoxy-5-[(1S)-1-methylpropyl]benzoic acid Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16O4/c1-4-8(2)10-5-6-12(17-9(3)14)11(7-10)13(15)16/h5-8H,4H2,1-3H3,(H,15,16)/t8-/m0/s1