4-[(4-chloranyl-2-fluoranyl-5-oxidanyl-phenyl)amino]-7-(2-dimethylaminoethyloxy)-6-methoxy-quinoline-3-carbonitrile

Systemtic Name: 4-[(4-chloranyl-2-fluoranyl-5-oxidanyl-phenyl)amino]-7-(2-dimethylaminoethyloxy)-6-methoxy-quinoline-3-carbonitrile Openeye Name: 4-(4-chloro-2-fluoro-5-hydroxy-anilino)-7-(2-dimethylaminoethyloxy)-6-methoxy-quinoline-3-carbonitrile CAS Name: 4-(4-chloro-2-fluoro-5-hydroxyanilino)-7-(2-dimethylaminoethyloxy)-6-methoxy-3-quinolinecarbonitrile IUPAC Name: 4-(4-chloro-2-fluoro-5-hydroxyanilino)-7-(2-dimethylaminoethyloxy)-6-methoxyquinoline-3-carbonitrile Traditional Name: 4-(4-chloro-2-fluoro-5-hydroxy-anilino)-7-(2-dimethylaminoethyloxy)-6-methoxy-quinoline-3-carbonitrile Formula: C21H20ClFN4O3 MolecularWeight: 430.859903

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCOC1=C(C=C2C(=C1)N=CC(=C2NC3=CC(=C(C=C3F)Cl)O)C#N)OC

Isomeric SMILES

CN(C)CCOC1=C(C=C2C(=C1)N=CC(=C2NC3=CC(=C(C=C3F)Cl)O)C#N)OC

InChI

InChI=1S/C21H20ClFN4O3/c1-27(2)4-5-30-20-9-16-13(6-19(20)29-3)21(12(10-24)11-25-16)26-17-8-18(28)14(22)7-15(17)23/h6-9,11,28H,4-5H2,1-3H3,(H,25,26)