2-[(4-bromanyl-2-methyl-phenyl)amino]-3,4-bis(fluoranyl)-N-phenethyl-benzamide

Systemtic Name: 2-[(4-bromanyl-2-methyl-phenyl)amino]-3,4-bis(fluoranyl)-N-phenethyl-benzamide Openeye Name: 2-(4-bromo-2-methyl-anilino)-3,4-difluoro-N-phenethyl-benzamide CAS Name: 2-(4-bromo-2-methylanilino)-3,4-difluoro-N-phenethylbenzamide IUPAC Name: 2-(4-bromo-2-methylanilino)-3,4-difluoro-N-phenethylbenzamide Traditional Name: 2-(4-bromo-2-methyl-anilino)-3,4-difluoro-N-phenethyl-benzamide Formula: C22H19BrF2N2O MolecularWeight: 445.299866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC2=C(C=CC(=C2F)F)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC2=C(C=CC(=C2F)F)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C22H19BrF2N2O/c1-14-13-16(23)7-10-19(14)27-21-17(8-9-18(24)20(21)25)22(28)26-12-11-15-5-3-2-4-6-15/h2-10,13,27H,11-12H2,1H3,(H,26,28)