2-[(2-methylpropan-2-yl)oxycarbonyl]octanoic acid

Systemtic Name: 2-[(2-methylpropan-2-yl)oxycarbonyl]octanoic acid Openeye Name: 2-tert-butoxycarbonyloctanoic acid CAS Name: 2-[(2-methylpropan-2-yl)oxy-oxomethyl]octanoic acid IUPAC Name: 2-[(2-methylpropan-2-yl)oxycarbonyl]octanoic acid Traditional Name: 2-tert-butoxycarbonylcaprylic acid Formula: C13H24O4 MolecularWeight: 244.32726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)O)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCC(C(=O)O)C(=O)OC(C)(C)C

InChI

InChI=1S/C13H24O4/c1-5-6-7-8-9-10(11(14)15)12(16)17-13(2,3)4/h10H,5-9H2,1-4H3,(H,14,15)