6-oxidanylidene-6-(16-oxidanylidenehexadecanoylamino)-5-[(2-phenylphenyl)carbonylamino]hexanoic acid

Systemtic Name: 6-oxidanylidene-6-(16-oxidanylidenehexadecanoylamino)-5-[(2-phenylphenyl)carbonylamino]hexanoic acid Openeye Name: 6-oxo-6-(16-oxohexadecanoylamino)-5-[(2-phenylbenzoyl)amino]hexanoic acid CAS Name: 6-(1,16-dioxohexadecylamino)-6-oxo-5-[[oxo-(2-phenylphenyl)methyl]amino]hexanoic acid IUPAC Name: 6-oxo-6-(16-oxohexadecanoylamino)-5-[(2-phenylbenzoyl)amino]hexanoic acid Traditional Name: 6-keto-6-(16-ketohexadecanoylamino)-5-[(2-phenylbenzoyl)amino]hexanoic acid Formula: C35H48N2O6 MolecularWeight: 592.76542

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=CC=C2C(=O)NC(CCCC(=O)O)C(=O)NC(=O)CCCCCCCCCCCCCCC=O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=CC=C2C(=O)NC(CCCC(=O)O)C(=O)NC(=O)CCCCCCCCCCCCCCC=O

InChI

InChI=1S/C35H48N2O6/c38-27-18-11-9-7-5-3-1-2-4-6-8-10-15-25-32(39)37-35(43)31(24-19-26-33(40)41)36-34(42)30-23-17-16-22-29(30)28-20-13-12-14-21-28/h12-14,16-17,20-23,27,31H,1-11,15,18-19,24-26H2,(H,36,42)(H,40,41)(H,37,39,43)