4-[[2,4-bis(chloranyl)-5-methoxy-phenyl]amino]-7-naphthalen-1-yl-quinoline-3-carbonitrile

Systemtic Name: 4-[[2,4-bis(chloranyl)-5-methoxy-phenyl]amino]-7-naphthalen-1-yl-quinoline-3-carbonitrile Openeye Name: 4-(2,4-dichloro-5-methoxy-anilino)-7-(1-naphthyl)quinoline-3-carbonitrile CAS Name: 4-(2,4-dichloro-5-methoxyanilino)-7-(1-naphthalenyl)-3-quinolinecarbonitrile IUPAC Name: 4-(2,4-dichloro-5-methoxyanilino)-7-naphthalen-1-ylquinoline-3-carbonitrile Traditional Name: 4-(2,4-dichloro-5-methoxy-anilino)-7-(1-naphthyl)quinoline-3-carbonitrile Formula: C27H17Cl2N3O MolecularWeight: 470.34938

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)NC2=C3C=CC(=CC3=NC=C2C#N)C4=CC=CC5=CC=CC=C54)Cl)Cl

Isomeric SMILES

COC1=C(C=C(C(=C1)NC2=C3C=CC(=CC3=NC=C2C#N)C4=CC=CC5=CC=CC=C54)Cl)Cl

InChI

InChI=1S/C27H17Cl2N3O/c1-33-26-13-25(22(28)12-23(26)29)32-27-18(14-30)15-31-24-11-17(9-10-21(24)27)20-8-4-6-16-5-2-3-7-19(16)20/h2-13,15H,1H3,(H,31,32)