3-benzamido-N-[(5-bromanyl-2-fluoranyl-phenyl)methyl]-4-methyl-benzamide

Systemtic Name: 3-benzamido-N-[(5-bromanyl-2-fluoranyl-phenyl)methyl]-4-methyl-benzamide Openeye Name: 3-benzamido-N-[(5-bromo-2-fluoro-phenyl)methyl]-4-methyl-benzamide CAS Name: 3-benzamido-N-[(5-bromo-2-fluorophenyl)methyl]-4-methylbenzamide IUPAC Name: 3-benzamido-N-[(5-bromo-2-fluorophenyl)methyl]-4-methylbenzamide Traditional Name: 3-benzamido-N-(5-bromo-2-fluoro-benzyl)-4-methyl-benzamide Formula: C22H18BrFN2O2 MolecularWeight: 441.292923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC2=C(C=CC(=C2)Br)F)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC2=C(C=CC(=C2)Br)F)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H18BrFN2O2/c1-14-7-8-16(12-20(14)26-22(28)15-5-3-2-4-6-15)21(27)25-13-17-11-18(23)9-10-19(17)24/h2-12H,13H2,1H3,(H,25,27)(H,26,28)