6-[2-hexadecanoyl-2-(phenylmethyl)hydrazinyl]-6-oxidanylidene-5-(quinolin-2-ylcarbonylamino)hexanoic acid

Systemtic Name: 6-[2-hexadecanoyl-2-(phenylmethyl)hydrazinyl]-6-oxidanylidene-5-(quinolin-2-ylcarbonylamino)hexanoic acid Openeye Name: 6-(2-benzyl-2-hexadecanoyl-hydrazino)-6-oxo-5-(quinoline-2-carbonylamino)hexanoic acid CAS Name: 6-oxo-6-[2-(1-oxohexadecyl)-2-(phenylmethyl)hydrazinyl]-5-[[oxo(2-quinolinyl)methyl]amino]hexanoic acid IUPAC Name: 6-(2-benzyl-2-hexadecanoylhydrazinyl)-6-oxo-5-(quinoline-2-carbonylamino)hexanoic acid Traditional Name: 6-(N'-benzyl-N'-hexadecanoyl-hydrazino)-6-keto-5-(quinaldoylamino)hexanoic acid Formula: C39H54N4O5 MolecularWeight: 658.86986

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)N(CC1=CC=CC=C1)NC(=O)C(CCCC(=O)O)NC(=O)C2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)N(CC1=CC=CC=C1)NC(=O)C(CCCC(=O)O)NC(=O)C2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C39H54N4O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-26-36(44)43(30-31-21-15-14-16-22-31)42-39(48)34(25-20-27-37(45)46)41-38(47)35-29-28-32-23-18-19-24-33(32)40-35/h14-16,18-19,21-24,28-29,34H,2-13,17,20,25-27,30H2,1H3,(H,41,47)(H,42,48)(H,45,46)