2-quinolin-3-yl-3-[5-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pentanoylamino]propanoic acid

Systemtic Name: 2-quinolin-3-yl-3-[5-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pentanoylamino]propanoic acid Openeye Name: 2-(3-quinolyl)-3-[5-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pentanoylamino]propanoic acid CAS Name: 3-[[1-oxo-5-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pentyl]amino]-2-(3-quinolinyl)propanoic acid IUPAC Name: 2-quinolin-3-yl-3-[5-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pentanoylamino]propanoic acid Traditional Name: 2-(3-quinolyl)-3-[5-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)pentanoylamino]propionic acid Formula: C25H28N4O3 MolecularWeight: 432.51482

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(NC1)N=C(C=C2)CCCCC(=O)NCC(C3=CC4=CC=CC=C4N=C3)C(=O)O

Isomeric SMILES

C1CC2=C(NC1)N=C(C=C2)CCCCC(=O)NCC(C3=CC4=CC=CC=C4N=C3)C(=O)O

InChI

InChI=1S/C25H28N4O3/c30-23(10-4-2-8-20-12-11-17-7-5-13-26-24(17)29-20)28-16-21(25(31)32)19-14-18-6-1-3-9-22(18)27-15-19/h1,3,6,9,11-12,14-15,21H,2,4-5,7-8,10,13,16H2,(H,26,29)(H,28,30)(H,31,32)