3-[5-(2-azanylpyridin-4-yl)pentanoylamino]-3-quinolin-3-yl-propanoic acid

Systemtic Name: 3-[5-(2-azanylpyridin-4-yl)pentanoylamino]-3-quinolin-3-yl-propanoic acid Openeye Name: 3-[5-(2-amino-4-pyridyl)pentanoylamino]-3-(3-quinolyl)propanoic acid CAS Name: 3-[[5-(2-amino-4-pyridinyl)-1-oxopentyl]amino]-3-(3-quinolinyl)propanoic acid IUPAC Name: 3-[5-(2-aminopyridin-4-yl)pentanoylamino]-3-quinolin-3-ylpropanoic acid Traditional Name: 3-[5-(2-amino-4-pyridyl)pentanoylamino]-3-(3-quinolyl)propionic acid Formula: C22H24N4O3 MolecularWeight: 392.45096

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C=N2)C(CC(=O)O)NC(=O)CCCCC3=CC(=NC=C3)N

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C=N2)C(CC(=O)O)NC(=O)CCCCC3=CC(=NC=C3)N

InChI

InChI=1S/C22H24N4O3/c23-20-11-15(9-10-24-20)5-1-4-8-21(27)26-19(13-22(28)29)17-12-16-6-2-3-7-18(16)25-14-17/h2-3,6-7,9-12,14,19H,1,4-5,8,13H2,(H2,23,24)(H,26,27)(H,28,29)