4-[[2,4-bis(chloranyl)-5-methoxy-phenyl]amino]-6-bromanyl-quinoline-3-carbonitrile

Systemtic Name: 4-[[2,4-bis(chloranyl)-5-methoxy-phenyl]amino]-6-bromanyl-quinoline-3-carbonitrile Openeye Name: 6-bromo-4-(2,4-dichloro-5-methoxy-anilino)quinoline-3-carbonitrile CAS Name: 6-bromo-4-(2,4-dichloro-5-methoxyanilino)-3-quinolinecarbonitrile IUPAC Name: 6-bromo-4-(2,4-dichloro-5-methoxyanilino)quinoline-3-carbonitrile Traditional Name: 6-bromo-4-(2,4-dichloro-5-methoxy-anilino)quinoline-3-carbonitrile Formula: C17H10BrCl2N3O MolecularWeight: 423.0908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)NC2=C3C=C(C=CC3=NC=C2C#N)Br)Cl)Cl

Isomeric SMILES

COC1=C(C=C(C(=C1)NC2=C3C=C(C=CC3=NC=C2C#N)Br)Cl)Cl

InChI

InChI=1S/C17H10BrCl2N3O/c1-24-16-6-15(12(19)5-13(16)20)23-17-9(7-21)8-22-14-3-2-10(18)4-11(14)17/h2-6,8H,1H3,(H,22,23)