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

Systemtic Name: 4-[[2,4-bis(chloranyl)-5-methoxy-phenyl]amino]-7-(2-pyridin-4-ylethyl)quinoline-3-carbonitrile Openeye Name: 4-(2,4-dichloro-5-methoxy-anilino)-7-[2-(4-pyridyl)ethyl]quinoline-3-carbonitrile CAS Name: 4-(2,4-dichloro-5-methoxyanilino)-7-(2-pyridin-4-ylethyl)-3-quinolinecarbonitrile IUPAC Name: 4-(2,4-dichloro-5-methoxyanilino)-7-(2-pyridin-4-ylethyl)quinoline-3-carbonitrile Traditional Name: 4-(2,4-dichloro-5-methoxy-anilino)-7-[2-(4-pyridyl)ethyl]quinoline-3-carbonitrile Formula: C24H18Cl2N4O MolecularWeight: 449.33192

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)NC2=C3C=CC(=CC3=NC=C2C#N)CCC4=CC=NC=C4)Cl)Cl

Isomeric SMILES

COC1=C(C=C(C(=C1)NC2=C3C=CC(=CC3=NC=C2C#N)CCC4=CC=NC=C4)Cl)Cl

InChI

InChI=1S/C24H18Cl2N4O/c1-31-23-12-22(19(25)11-20(23)26)30-24-17(13-27)14-29-21-10-16(4-5-18(21)24)3-2-15-6-8-28-9-7-15/h4-12,14H,2-3H2,1H3,(H,29,30)