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

Systemtic Name: (phenylmethyl) 6-(2-hexadecanoyl-2-methyl-hydrazinyl)-6-oxidanylidene-5-(quinolin-2-ylcarbonylamino)hexanoate Openeye Name: benzyl 6-(2-hexadecanoyl-2-methyl-hydrazino)-6-oxo-5-(quinoline-2-carbonylamino)hexanoate CAS Name: 6-[2-methyl-2-(1-oxohexadecyl)hydrazinyl]-6-oxo-5-[[oxo(2-quinolinyl)methyl]amino]hexanoic acid (phenylmethyl) ester IUPAC Name: benzyl 6-(2-hexadecanoyl-2-methylhydrazinyl)-6-oxo-5-(quinoline-2-carbonylamino)hexanoate Traditional Name: 6-(N'-hexadecanoyl-N'-methyl-hydrazino)-6-keto-5-(quinaldoylamino)hexanoic acid benzyl ester Formula: C40H56N4O5 MolecularWeight: 672.89644

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C40H56N4O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-18-27-37(45)44(2)43-40(48)35(26-21-28-38(46)49-31-32-22-16-15-17-23-32)42-39(47)36-30-29-33-24-19-20-25-34(33)41-36/h15-17,19-20,22-25,29-30,35H,3-14,18,21,26-28,31H2,1-2H3,(H,42,47)(H,43,48)