2-[5-azanyl-4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyloxy]-5-oxidanylidene-pentyl]dodecanoic acid

Systemtic Name: 2-[5-azanyl-4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyloxy]-5-oxidanylidene-pentyl]dodecanoic acid Openeye Name: 2-[5-amino-4-[2-(tert-butoxycarbonylamino)hexanoyloxy]-5-oxo-pentyl]dodecanoic acid CAS Name: 2-[5-amino-4-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxohexoxy]-5-oxopentyl]dodecanoic acid IUPAC Name: 2-[5-amino-4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoyloxy]-5-oxopentyl]dodecanoic acid Traditional Name: 2-[5-amino-4-[2-(tert-butoxycarbonylamino)hexanoyloxy]-5-keto-pentyl]lauric acid Formula: C28H52N2O7 MolecularWeight: 528.72168

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H52N2O7/c1-6-8-10-11-12-13-14-15-17-21(25(32)33)18-16-20-23(24(29)31)36-26(34)22(19-9-7-2)30-27(35)37-28(3,4)5/h21-23H,6-20H2,1-5H3,(H2,29,31)(H,30,35)(H,32,33)