N-[5-(5-chloranyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]-4-cyano-2-fluoranyl-benzamide

Systemtic Name: N-[5-(5-chloranyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]-4-cyano-2-fluoranyl-benzamide Openeye Name: N-[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methyl-phenyl]-4-cyano-2-fluoro-benzamide CAS Name: N-[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]-4-cyano-2-fluorobenzamide IUPAC Name: N-[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methylphenyl]-4-cyano-2-fluorobenzamide Traditional Name: N-[5-(5-chloro-1,3-benzoxazol-2-yl)-2-methyl-phenyl]-4-cyano-2-fluoro-benzamide Formula: C22H13ClFN3O2 MolecularWeight: 405.808923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)Cl)NC(=O)C4=C(C=C(C=C4)C#N)F

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)Cl)NC(=O)C4=C(C=C(C=C4)C#N)F

InChI

InChI=1S/C22H13ClFN3O2/c1-12-2-4-14(22-27-19-10-15(23)5-7-20(19)29-22)9-18(12)26-21(28)16-6-3-13(11-25)8-17(16)24/h2-10H,1H3,(H,26,28)