6-(16-azanylhexadecanoylamino)-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-(16-azanylhexadecanoylamino)-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-hexanoic acid Openeye Name: 6-(16-aminohexadecanoylamino)-5-(tert-butoxycarbonylamino)-6-oxo-hexanoic acid CAS Name: 6-[(16-amino-1-oxohexadecyl)amino]-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-oxohexanoic acid IUPAC Name: 6-(16-aminohexadecanoylamino)-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxohexanoic acid Traditional Name: 6-(16-aminohexadecanoylamino)-5-(tert-butoxycarbonylamino)-6-keto-hexanoic acid Formula: C27H51N3O6 MolecularWeight: 513.71034

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H51N3O6/c1-27(2,3)36-26(35)29-22(18-17-20-24(32)33)25(34)30-23(31)19-15-13-11-9-7-5-4-6-8-10-12-14-16-21-28/h22H,4-21,28H2,1-3H3,(H,29,35)(H,32,33)(H,30,31,34)