3-[2-[5-(pyridin-2-ylamino)pentanoylamino]ethanoylamino]pent-4-ynoic acid

Systemtic Name: 3-[2-[5-(pyridin-2-ylamino)pentanoylamino]ethanoylamino]pent-4-ynoic acid Openeye Name: 3-[[2-[5-(2-pyridylamino)pentanoylamino]acetyl]amino]pent-4-ynoic acid CAS Name: 3-[[1-oxo-2-[[1-oxo-5-(2-pyridinylamino)pentyl]amino]ethyl]amino]-4-pentynoic acid IUPAC Name: 3-[[2-[5-(pyridin-2-ylamino)pentanoylamino]acetyl]amino]pent-4-ynoic acid Traditional Name: 3-[[2-[5-(2-pyridylamino)pentanoylamino]acetyl]amino]pent-4-ynoic acid Formula: C17H22N4O4 MolecularWeight: 346.38098

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Descriptors Computed from Structure

Canonical SMILES:

C#CC(CC(=O)O)NC(=O)CNC(=O)CCCCNC1=CC=CC=N1

Isomeric SMILES

C#CC(CC(=O)O)NC(=O)CNC(=O)CCCCNC1=CC=CC=N1

InChI

InChI=1S/C17H22N4O4/c1-2-13(11-17(24)25)21-16(23)12-20-15(22)8-4-6-10-19-14-7-3-5-9-18-14/h1,3,5,7,9,13H,4,6,8,10-12H2,(H,18,19)(H,20,22)(H,21,23)(H,24,25)