O1-(15-oxidanylidenepentadecanoyl) O6-(phenylmethyl) 2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanedioate

Systemtic Name: O1-(15-oxidanylidenepentadecanoyl) O6-(phenylmethyl) 2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanedioate Openeye Name: O6-benzyl O1-(15-oxopentadecanoyl) 2-(tert-butoxycarbonylamino)hexanedioate CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]hexanedioic acid O1-(1,15-dioxopentadecyl) ester O6-(phenylmethyl) ester IUPAC Name: 6-O-benzyl 1-O-(15-oxopentadecanoyl) 2-[(2-methylpropan-2-yl)oxycarbonylamino]hexanedioate Traditional Name: 2-(tert-butoxycarbonylamino)adipic acid O6-benzyl ester O1-(15-ketopentadecanoyl) ester Formula: C33H51NO8 MolecularWeight: 589.75994

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCCC(=O)OCC1=CC=CC=C1)C(=O)OC(=O)CCCCCCCCCCCCCC=O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CCCC(=O)OCC1=CC=CC=C1)C(=O)OC(=O)CCCCCCCCCCCCCC=O

InChI

InChI=1S/C33H51NO8/c1-33(2,3)42-32(39)34-28(22-19-24-29(36)40-26-27-20-15-14-16-21-27)31(38)41-30(37)23-17-12-10-8-6-4-5-7-9-11-13-18-25-35/h14-16,20-21,25,28H,4-13,17-19,22-24,26H2,1-3H3,(H,34,39)