4-[[2,4-bis(chloranyl)-5-methoxy-phenyl]amino]-6-methoxy-7-phenylmethoxy-quinoline-3-carbonitrile

Systemtic Name: 4-[[2,4-bis(chloranyl)-5-methoxy-phenyl]amino]-6-methoxy-7-phenylmethoxy-quinoline-3-carbonitrile Openeye Name: 7-benzyloxy-4-(2,4-dichloro-5-methoxy-anilino)-6-methoxy-quinoline-3-carbonitrile CAS Name: 4-(2,4-dichloro-5-methoxyanilino)-6-methoxy-7-phenylmethoxy-3-quinolinecarbonitrile IUPAC Name: 4-(2,4-dichloro-5-methoxyanilino)-6-methoxy-7-phenylmethoxyquinoline-3-carbonitrile Traditional Name: 7-benzoxy-4-(2,4-dichloro-5-methoxy-anilino)-6-methoxy-quinoline-3-carbonitrile Formula: C25H19Cl2N3O3 MolecularWeight: 480.34266

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=C(C=N2)C#N)NC3=CC(=C(C=C3Cl)Cl)OC)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=C(C=N2)C#N)NC3=CC(=C(C=C3Cl)Cl)OC)OCC4=CC=CC=C4

InChI

InChI=1S/C25H19Cl2N3O3/c1-31-22-11-21(18(26)9-19(22)27)30-25-16(12-28)13-29-20-10-24(23(32-2)8-17(20)25)33-14-15-6-4-3-5-7-15/h3-11,13H,14H2,1-2H3,(H,29,30)