N2-(4-bromanyl-2-fluoranyl-phenyl)-N1-[(4-methylphenyl)methyl]cyclohexene-1,2-dicarboxamide

Systemtic Name: N2-(4-bromanyl-2-fluoranyl-phenyl)-N1-[(4-methylphenyl)methyl]cyclohexene-1,2-dicarboxamide Openeye Name: N2-(4-bromo-2-fluoro-phenyl)-N1-(p-tolylmethyl)cyclohexene-1,2-dicarboxamide CAS Name: N2-(4-bromo-2-fluorophenyl)-N1-[(4-methylphenyl)methyl]cyclohexene-1,2-dicarboxamide IUPAC Name: 2-N-(4-bromo-2-fluorophenyl)-1-N-[(4-methylphenyl)methyl]cyclohexene-1,2-dicarboxamide Traditional Name: N'-(4-bromo-2-fluoro-phenyl)-N-(4-methylbenzyl)cyclohexene-1,2-dicarboxamide Formula: C22H22BrFN2O2 MolecularWeight: 445.324683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C2=C(CCCC2)C(=O)NC3=C(C=C(C=C3)Br)F

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)C2=C(CCCC2)C(=O)NC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C22H22BrFN2O2/c1-14-6-8-15(9-7-14)13-25-21(27)17-4-2-3-5-18(17)22(28)26-20-11-10-16(23)12-19(20)24/h6-12H,2-5,13H2,1H3,(H,25,27)(H,26,28)