6-[1-(methylamino)-1-oxidanylidene-hexadecan-3-yl]oxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-[1-(methylamino)-1-oxidanylidene-hexadecan-3-yl]oxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-hexanoic acid Openeye Name: 5-(tert-butoxycarbonylamino)-6-[1-[2-(methylamino)-2-oxo-ethyl]tetradecoxy]-6-oxo-hexanoic acid CAS Name: 6-[1-(methylamino)-1-oxohexadecan-3-yl]oxy-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-oxohexanoic acid IUPAC Name: 6-[1-(methylamino)-1-oxohexadecan-3-yl]oxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxohexanoic acid Traditional Name: 5-(tert-butoxycarbonylamino)-6-keto-6-[1-[2-keto-2-(methylamino)ethyl]tetradecoxy]hexanoic acid Formula: C28H52N2O7 MolecularWeight: 528.72168

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H52N2O7/c1-6-7-8-9-10-11-12-13-14-15-16-18-22(21-24(31)29-5)36-26(34)23(19-17-20-25(32)33)30-27(35)37-28(2,3)4/h22-23H,6-21H2,1-5H3,(H,29,31)(H,30,35)(H,32,33)