N-[4-[(7-chloranylquinolin-4-yl)amino]-1,1,2,2-tetradeuterio-pentyl]-2-oxidanyl-ethanamide

Systemtic Name: N-[4-[(7-chloranylquinolin-4-yl)amino]-1,1,2,2-tetradeuterio-pentyl]-2-oxidanyl-ethanamide Openeye Name: N-[4-[(7-chloro-4-quinolyl)amino]-1,1,2,2-tetradeuterio-pentyl]-2-hydroxy-acetamide CAS Name: N-[4-[(7-chloro-4-quinolinyl)amino]-1,1,2,2-tetradeuteriopentyl]-2-hydroxyacetamide IUPAC Name: N-[4-[(7-chloroquinolin-4-yl)amino]-1,1,2,2-tetradeuteriopentyl]-2-hydroxyacetamide Traditional Name: N-[4-[(7-chloro-4-quinolyl)amino]-1,1,2,2-tetradeuterio-pentyl]-2-hydroxy-acetamide Formula: C16H20ClN3O2 MolecularWeight: 325.826547

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCCNC(=O)CO)NC1=C2C=CC(=CC2=NC=C1)Cl

Isomeric SMILES

[2H]C([2H])(CC(C)NC1=C2C=CC(=CC2=NC=C1)Cl)C([2H])([2H])NC(=O)CO

InChI

InChI=1S/C16H20ClN3O2/c1-11(3-2-7-19-16(22)10-21)20-14-6-8-18-15-9-12(17)4-5-13(14)15/h4-6,8-9,11,21H,2-3,7,10H2,1H3,(H,18,20)(H,19,22)/i2D2,7D2