4-[[2,4-bis(chloranyl)-5-methoxy-phenyl]amino]-7-(4-methanoylphenyl)quinoline-3-carbonitrile

Systemtic Name: 4-[[2,4-bis(chloranyl)-5-methoxy-phenyl]amino]-7-(4-methanoylphenyl)quinoline-3-carbonitrile Openeye Name: 4-(2,4-dichloro-5-methoxy-anilino)-7-(4-formylphenyl)quinoline-3-carbonitrile CAS Name: 4-(2,4-dichloro-5-methoxyanilino)-7-(4-formylphenyl)-3-quinolinecarbonitrile IUPAC Name: 4-(2,4-dichloro-5-methoxyanilino)-7-(4-formylphenyl)quinoline-3-carbonitrile Traditional Name: 4-(2,4-dichloro-5-methoxy-anilino)-7-(4-formylphenyl)quinoline-3-carbonitrile Formula: C24H15Cl2N3O2 MolecularWeight: 448.3008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)NC2=C3C=CC(=CC3=NC=C2C#N)C4=CC=C(C=C4)C=O)Cl)Cl

Isomeric SMILES

COC1=C(C=C(C(=C1)NC2=C3C=CC(=CC3=NC=C2C#N)C4=CC=C(C=C4)C=O)Cl)Cl

InChI

InChI=1S/C24H15Cl2N3O2/c1-31-23-10-22(19(25)9-20(23)26)29-24-17(11-27)12-28-21-8-16(6-7-18(21)24)15-4-2-14(13-30)3-5-15/h2-10,12-13H,1H3,(H,28,29)