5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-6-(12-oxidanylidenedodecanoylamino)hexanoic acid

Systemtic Name: 5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-6-(12-oxidanylidenedodecanoylamino)hexanoic acid Openeye Name: 5-(tert-butoxycarbonylamino)-6-oxo-6-(12-oxododecanoylamino)hexanoic acid CAS Name: 6-(1,12-dioxododecylamino)-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-oxohexanoic acid IUPAC Name: 5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxo-6-(12-oxododecanoylamino)hexanoic acid Traditional Name: 5-(tert-butoxycarbonylamino)-6-keto-6-(12-ketododecanoylamino)hexanoic acid Formula: C23H40N2O7 MolecularWeight: 456.5729

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCCC(=O)O)C(=O)NC(=O)CCCCCCCCCCC=O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CCCC(=O)O)C(=O)NC(=O)CCCCCCCCCCC=O

InChI

InChI=1S/C23H40N2O7/c1-23(2,3)32-22(31)24-18(14-13-16-20(28)29)21(30)25-19(27)15-11-9-7-5-4-6-8-10-12-17-26/h17-18H,4-16H2,1-3H3,(H,24,31)(H,28,29)(H,25,27,30)