(phenylmethyl) 6-(2-ethyl-2-hexadecanoyl-hydrazinyl)-6-oxidanylidene-5-(quinolin-2-ylcarbonylamino)hexanoate

Systemtic Name: (phenylmethyl) 6-(2-ethyl-2-hexadecanoyl-hydrazinyl)-6-oxidanylidene-5-(quinolin-2-ylcarbonylamino)hexanoate Openeye Name: benzyl 6-(2-ethyl-2-hexadecanoyl-hydrazino)-6-oxo-5-(quinoline-2-carbonylamino)hexanoate CAS Name: 6-[2-ethyl-2-(1-oxohexadecyl)hydrazinyl]-6-oxo-5-[[oxo(2-quinolinyl)methyl]amino]hexanoic acid (phenylmethyl) ester IUPAC Name: benzyl 6-(2-ethyl-2-hexadecanoylhydrazinyl)-6-oxo-5-(quinoline-2-carbonylamino)hexanoate Traditional Name: 6-(N'-ethyl-N'-hexadecanoyl-hydrazino)-6-keto-5-(quinaldoylamino)hexanoic acid benzyl ester Formula: C41H58N4O5 MolecularWeight: 686.92302

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)N(CC)NC(=O)C(CCCC(=O)OCC1=CC=CC=C1)NC(=O)C2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)N(CC)NC(=O)C(CCCC(=O)OCC1=CC=CC=C1)NC(=O)C2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C41H58N4O5/c1-3-5-6-7-8-9-10-11-12-13-14-15-19-28-38(46)45(4-2)44-41(49)36(27-22-29-39(47)50-32-33-23-17-16-18-24-33)43-40(48)37-31-30-34-25-20-21-26-35(34)42-37/h16-18,20-21,23-26,30-31,36H,3-15,19,22,27-29,32H2,1-2H3,(H,43,48)(H,44,49)