4-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-octanoic acid

Systemtic Name: 4-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-octanoic acid Openeye Name: 4-(tert-butoxycarbonylamino)-3-oxo-octanoic acid CAS Name: 4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-oxooctanoic acid IUPAC Name: 4-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxooctanoic acid Traditional Name: 4-(tert-butoxycarbonylamino)-3-keto-caprylic acid Formula: C13H23NO5 MolecularWeight: 273.32542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)CC(=O)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCC(C(=O)CC(=O)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C13H23NO5/c1-5-6-7-9(10(15)8-11(16)17)14-12(18)19-13(2,3)4/h9H,5-8H2,1-4H3,(H,14,18)(H,16,17)