6-oxidanylidene-6-(16-oxidanylidenehexadecanoylamino)-5-(quinolin-5-ylcarbonylamino)hexanoic acid

Systemtic Name: 6-oxidanylidene-6-(16-oxidanylidenehexadecanoylamino)-5-(quinolin-5-ylcarbonylamino)hexanoic acid Openeye Name: 6-oxo-6-(16-oxohexadecanoylamino)-5-(quinoline-5-carbonylamino)hexanoic acid CAS Name: 6-(1,16-dioxohexadecylamino)-6-oxo-5-[[oxo(5-quinolinyl)methyl]amino]hexanoic acid IUPAC Name: 6-oxo-6-(16-oxohexadecanoylamino)-5-(quinoline-5-carbonylamino)hexanoic acid Traditional Name: 6-keto-6-(16-ketohexadecanoylamino)-5-(quinoline-5-carbonylamino)hexanoic acid Formula: C32H45N3O6 MolecularWeight: 567.7162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C=CC=NC2=C1)C(=O)NC(CCCC(=O)O)C(=O)NC(=O)CCCCCCCCCCCCCCC=O

Isomeric SMILES

C1=CC(=C2C=CC=NC2=C1)C(=O)NC(CCCC(=O)O)C(=O)NC(=O)CCCCCCCCCCCCCCC=O

InChI

InChI=1S/C32H45N3O6/c36-24-13-11-9-7-5-3-1-2-4-6-8-10-12-21-29(37)35-32(41)28(20-15-22-30(38)39)34-31(40)26-17-14-19-27-25(26)18-16-23-33-27/h14,16-19,23-24,28H,1-13,15,20-22H2,(H,34,40)(H,38,39)(H,35,37,41)