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

Systemtic Name: (phenylmethyl) 6-[2-hexadecanoyl-2-(2-methylpropyl)hydrazinyl]-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-hexanoate Openeye Name: benzyl 5-(tert-butoxycarbonylamino)-6-(2-hexadecanoyl-2-isobutyl-hydrazino)-6-oxo-hexanoate CAS Name: 5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-[2-(2-methylpropyl)-2-(1-oxohexadecyl)hydrazinyl]-6-oxohexanoic acid (phenylmethyl) ester IUPAC Name: benzyl 6-[2-hexadecanoyl-2-(2-methylpropyl)hydrazinyl]-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxohexanoate Traditional Name: 5-(tert-butoxycarbonylamino)-6-(N'-hexadecanoyl-N'-isobutyl-hydrazino)-6-keto-hexanoic acid benzyl ester Formula: C38H65N3O6 MolecularWeight: 659.9392

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)N(CC(C)C)NC(=O)C(CCCC(=O)OCC1=CC=CC=C1)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)N(CC(C)C)NC(=O)C(CCCC(=O)OCC1=CC=CC=C1)NC(=O)OC(C)(C)C

InChI

InChI=1S/C38H65N3O6/c1-7-8-9-10-11-12-13-14-15-16-17-18-22-27-34(42)41(29-31(2)3)40-36(44)33(39-37(45)47-38(4,5)6)26-23-28-35(43)46-30-32-24-20-19-21-25-32/h19-21,24-25,31,33H,7-18,22-23,26-30H2,1-6H3,(H,39,45)(H,40,44)