3-[(5-chloranyl-2-oxidanyl-phenyl)methylamino]-5-fluoranyl-4-methyl-benzenecarbonitrile

Systemtic Name: 3-[(5-chloranyl-2-oxidanyl-phenyl)methylamino]-5-fluoranyl-4-methyl-benzenecarbonitrile Openeye Name: 3-[(5-chloro-2-hydroxy-phenyl)methylamino]-5-fluoro-4-methyl-benzonitrile CAS Name: 3-[(5-chloro-2-hydroxyphenyl)methylamino]-5-fluoro-4-methylbenzonitrile IUPAC Name: 3-[(5-chloro-2-hydroxyphenyl)methylamino]-5-fluoro-4-methylbenzonitrile Traditional Name: 3-[(5-chloro-2-hydroxy-benzyl)amino]-5-fluoro-4-methyl-benzonitrile Formula: C15H12ClFN2O MolecularWeight: 290.719983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1F)C#N)NCC2=C(C=CC(=C2)Cl)O

Isomeric SMILES

CC1=C(C=C(C=C1F)C#N)NCC2=C(C=CC(=C2)Cl)O

InChI

InChI=1S/C15H12ClFN2O/c1-9-13(17)4-10(7-18)5-14(9)19-8-11-6-12(16)2-3-15(11)20/h2-6,19-20H,8H2,1H3