4-[(4-chloranyl-2-fluoranyl-phenyl)amino]-7-(3-morpholin-4-ylpropoxy)quinoline-6-carbonitrile

Systemtic Name: 4-[(4-chloranyl-2-fluoranyl-phenyl)amino]-7-(3-morpholin-4-ylpropoxy)quinoline-6-carbonitrile Openeye Name: 4-(4-chloro-2-fluoro-anilino)-7-(3-morpholinopropoxy)quinoline-6-carbonitrile CAS Name: 4-(4-chloro-2-fluoroanilino)-7-[3-(4-morpholinyl)propoxy]-6-quinolinecarbonitrile IUPAC Name: 4-(4-chloro-2-fluoroanilino)-7-(3-morpholin-4-ylpropoxy)quinoline-6-carbonitrile Traditional Name: 4-(4-chloro-2-fluoro-anilino)-7-(3-morpholinopropoxy)quinoline-6-carbonitrile Formula: C23H22ClFN4O2 MolecularWeight: 440.897783

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCOC2=CC3=NC=CC(=C3C=C2C#N)NC4=C(C=C(C=C4)Cl)F

Isomeric SMILES

C1COCCN1CCCOC2=CC3=NC=CC(=C3C=C2C#N)NC4=C(C=C(C=C4)Cl)F

InChI

InChI=1S/C23H22ClFN4O2/c24-17-2-3-21(19(25)13-17)28-20-4-5-27-22-14-23(16(15-26)12-18(20)22)31-9-1-6-29-7-10-30-11-8-29/h2-5,12-14H,1,6-11H2,(H,27,28)