2-(decanoylamino)-3-quinolin-2-yl-propanoic acid

Systemtic Name: 2-(decanoylamino)-3-quinolin-2-yl-propanoic acid Openeye Name: 2-(decanoylamino)-3-(2-quinolyl)propanoic acid CAS Name: 2-(1-oxodecylamino)-3-(2-quinolinyl)propanoic acid IUPAC Name: 2-(decanoylamino)-3-quinolin-2-ylpropanoic acid Traditional Name: 2-(caprylamino)-3-(2-quinolyl)propionic acid Formula: C22H30N2O3 MolecularWeight: 370.4852

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)NC(CC1=NC2=CC=CC=C2C=C1)C(=O)O

Isomeric SMILES

CCCCCCCCCC(=O)NC(CC1=NC2=CC=CC=C2C=C1)C(=O)O

InChI

InChI=1S/C22H30N2O3/c1-2-3-4-5-6-7-8-13-21(25)24-20(22(26)27)16-18-15-14-17-11-9-10-12-19(17)23-18/h9-12,14-15,20H,2-8,13,16H2,1H3,(H,24,25)(H,26,27)