(phenylmethyl) 5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-6-(16-oxidanylidenehexadecanoylamino)hexanoate

Systemtic Name: (phenylmethyl) 5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-6-(16-oxidanylidenehexadecanoylamino)hexanoate Openeye Name: benzyl 5-(tert-butoxycarbonylamino)-6-oxo-6-(16-oxohexadecanoylamino)hexanoate CAS Name: 6-(1,16-dioxohexadecylamino)-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-oxohexanoic acid (phenylmethyl) ester IUPAC Name: benzyl 5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxo-6-(16-oxohexadecanoylamino)hexanoate Traditional Name: 5-(tert-butoxycarbonylamino)-6-keto-6-(16-ketohexadecanoylamino)hexanoic acid benzyl ester Formula: C34H54N2O7 MolecularWeight: 602.80176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C34H54N2O7/c1-34(2,3)43-33(41)35-29(23-20-25-31(39)42-27-28-21-16-15-17-22-28)32(40)36-30(38)24-18-13-11-9-7-5-4-6-8-10-12-14-19-26-37/h15-17,21-22,26,29H,4-14,18-20,23-25,27H2,1-3H3,(H,35,41)(H,36,38,40)