N-[2-bromanyl-5-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-4-fluoranyl-benzamide

Systemtic Name: N-[2-bromanyl-5-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-4-fluoranyl-benzamide Openeye Name: N-[2-bromo-5-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-4-fluoro-benzamide CAS Name: N-[2-bromo-5-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-4-fluorobenzamide IUPAC Name: N-[2-bromo-5-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-4-fluorobenzamide Traditional Name: N-[2-bromo-5-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-4-fluoro-benzamide Formula: C21H14BrFN2O2 MolecularWeight: 425.250463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(O2)C3=CC(=C(C=C3)Br)NC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(O2)C3=CC(=C(C=C3)Br)NC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H14BrFN2O2/c1-12-2-9-17-19(10-12)27-21(25-17)14-5-8-16(22)18(11-14)24-20(26)13-3-6-15(23)7-4-13/h2-11H,1H3,(H,24,26)