(phenylmethyl) 6-[2-hexadecanoyl-2-(pyridin-2-ylmethyl)hydrazinyl]-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-hexanoate

Systemtic Name: (phenylmethyl) 6-[2-hexadecanoyl-2-(pyridin-2-ylmethyl)hydrazinyl]-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-hexanoate Openeye Name: benzyl 5-(tert-butoxycarbonylamino)-6-[2-hexadecanoyl-2-(2-pyridylmethyl)hydrazino]-6-oxo-hexanoate CAS Name: 5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-oxo-6-[2-(1-oxohexadecyl)-2-(2-pyridinylmethyl)hydrazinyl]hexanoic acid (phenylmethyl) ester IUPAC Name: benzyl 6-[2-hexadecanoyl-2-(pyridin-2-ylmethyl)hydrazinyl]-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxohexanoate Traditional Name: 5-(tert-butoxycarbonylamino)-6-[N'-hexadecanoyl-N'-(2-pyridylmethyl)hydrazino]-6-keto-hexanoic acid benzyl ester Formula: C40H62N4O6 MolecularWeight: 694.94348

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)N(CC1=CC=CC=N1)NC(=O)C(CCCC(=O)OCC2=CC=CC=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)N(CC1=CC=CC=N1)NC(=O)C(CCCC(=O)OCC2=CC=CC=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C40H62N4O6/c1-5-6-7-8-9-10-11-12-13-14-15-16-20-28-36(45)44(31-34-26-21-22-30-41-34)43-38(47)35(42-39(48)50-40(2,3)4)27-23-29-37(46)49-32-33-24-18-17-19-25-33/h17-19,21-22,24-26,30,35H,5-16,20,23,27-29,31-32H2,1-4H3,(H,42,48)(H,43,47)