4-[[(2-chloranyl-6-fluoranyl-phenyl)methyl-(2-methoxy-4-oxidanyl-phenyl)amino]methyl]benzenecarbonitrile

Systemtic Name: 4-[[(2-chloranyl-6-fluoranyl-phenyl)methyl-(2-methoxy-4-oxidanyl-phenyl)amino]methyl]benzenecarbonitrile Openeye Name: 4-[[N-[(2-chloro-6-fluoro-phenyl)methyl]-4-hydroxy-2-methoxy-anilino]methyl]benzonitrile CAS Name: 4-[[N-[(2-chloro-6-fluorophenyl)methyl]-4-hydroxy-2-methoxyanilino]methyl]benzonitrile IUPAC Name: 4-[[N-[(2-chloro-6-fluorophenyl)methyl]-4-hydroxy-2-methoxyanilino]methyl]benzonitrile Traditional Name: 4-[(N-(2-chloro-6-fluoro-benzyl)-4-hydroxy-2-methoxy-anilino)methyl]benzonitrile Formula: C22H18ClFN2O2 MolecularWeight: 396.841923

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)O)N(CC2=CC=C(C=C2)C#N)CC3=C(C=CC=C3Cl)F

Isomeric SMILES

COC1=C(C=CC(=C1)O)N(CC2=CC=C(C=C2)C#N)CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C22H18ClFN2O2/c1-28-22-11-17(27)9-10-21(22)26(13-16-7-5-15(12-25)6-8-16)14-18-19(23)3-2-4-20(18)24/h2-11,27H,13-14H2,1H3