N-[3-[[2-(5-chloranylquinolin-8-yl)oxyethanoylamino]methyl]phenyl]-2-methyl-propanamide

Systemtic Name: N-[3-[[2-(5-chloranylquinolin-8-yl)oxyethanoylamino]methyl]phenyl]-2-methyl-propanamide Openeye Name: N-[3-[[[2-[(5-chloro-8-quinolyl)oxy]acetyl]amino]methyl]phenyl]-2-methyl-propanamide CAS Name: N-[3-[[[2-[(5-chloro-8-quinolinyl)oxy]-1-oxoethyl]amino]methyl]phenyl]-2-methylpropanamide IUPAC Name: N-[3-[[[2-(5-chloroquinolin-8-yl)oxyacetyl]amino]methyl]phenyl]-2-methylpropanamide Traditional Name: N-[3-[[[2-[(5-chloro-8-quinolyl)oxy]acetyl]amino]methyl]phenyl]-2-methyl-propionamide Formula: C22H22ClN3O3 MolecularWeight: 411.88138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=CC(=C1)CNC(=O)COC2=C3C(=C(C=C2)Cl)C=CC=N3

Isomeric SMILES

CC(C)C(=O)NC1=CC=CC(=C1)CNC(=O)COC2=C3C(=C(C=C2)Cl)C=CC=N3

InChI

InChI=1S/C22H22ClN3O3/c1-14(2)22(28)26-16-6-3-5-15(11-16)12-25-20(27)13-29-19-9-8-18(23)17-7-4-10-24-21(17)19/h3-11,14H,12-13H2,1-2H3,(H,25,27)(H,26,28)