1-[8-(2-chloranylpyridin-4-yl)oxy-4-[(2-methylphenyl)amino]quinolin-3-yl]butan-1-one

Systemtic Name: 1-[8-(2-chloranylpyridin-4-yl)oxy-4-[(2-methylphenyl)amino]quinolin-3-yl]butan-1-one Openeye Name: 1-[8-[(2-chloro-4-pyridyl)oxy]-4-(2-methylanilino)-3-quinolyl]butan-1-one CAS Name: 1-[8-[(2-chloro-4-pyridinyl)oxy]-4-(2-methylanilino)-3-quinolinyl]-1-butanone IUPAC Name: 1-[8-(2-chloropyridin-4-yl)oxy-4-(2-methylanilino)quinolin-3-yl]butan-1-one Traditional Name: 1-[8-[(2-chloro-4-pyridyl)oxy]-4-(o-toluidino)-3-quinolyl]butan-1-one Formula: C25H22ClN3O2 MolecularWeight: 431.91408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CN=C2C(=C1NC3=CC=CC=C3C)C=CC=C2OC4=CC(=NC=C4)Cl

Isomeric SMILES

CCCC(=O)C1=CN=C2C(=C1NC3=CC=CC=C3C)C=CC=C2OC4=CC(=NC=C4)Cl

InChI

InChI=1S/C25H22ClN3O2/c1-3-7-21(30)19-15-28-25-18(24(19)29-20-10-5-4-8-16(20)2)9-6-11-22(25)31-17-12-13-27-23(26)14-17/h4-6,8-15H,3,7H2,1-2H3,(H,28,29)