N2-(1-ethynylcyclohexyl)-N1-[3-(trifluoromethyl)phenyl]benzene-1,2-dicarboxamide

Systemtic Name: N2-(1-ethynylcyclohexyl)-N1-[3-(trifluoromethyl)phenyl]benzene-1,2-dicarboxamide Openeye Name: N2-(1-ethynylcyclohexyl)-N1-[3-(trifluoromethyl)phenyl]phthalamide CAS Name: N2-(1-ethynylcyclohexyl)-N1-[3-(trifluoromethyl)phenyl]benzene-1,2-dicarboxamide IUPAC Name: 2-N-(1-ethynylcyclohexyl)-1-N-[3-(trifluoromethyl)phenyl]benzene-1,2-dicarboxamide Traditional Name: N'-(1-ethynylcyclohexyl)-N-[3-(trifluoromethyl)phenyl]phthalamide Formula: C23H21F3N2O2 MolecularWeight: 414.42025

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1(CCCCC1)NC(=O)C2=CC=CC=C2C(=O)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C#CC1(CCCCC1)NC(=O)C2=CC=CC=C2C(=O)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C23H21F3N2O2/c1-2-22(13-6-3-7-14-22)28-21(30)19-12-5-4-11-18(19)20(29)27-17-10-8-9-16(15-17)23(24,25)26/h1,4-5,8-12,15H,3,6-7,13-14H2,(H,27,29)(H,28,30)