4-(azepan-1-ylmethyl)-N-[2-(trifluoromethyl)phenyl]benzamide

Systemtic Name: 4-(azepan-1-ylmethyl)-N-[2-(trifluoromethyl)phenyl]benzamide Openeye Name: 4-(azepan-1-ylmethyl)-N-[2-(trifluoromethyl)phenyl]benzamide CAS Name: 4-(1-azepanylmethyl)-N-[2-(trifluoromethyl)phenyl]benzamide IUPAC Name: 4-(azepan-1-ylmethyl)-N-[2-(trifluoromethyl)phenyl]benzamide Traditional Name: 4-(azepan-1-ylmethyl)-N-[2-(trifluoromethyl)phenyl]benzamide Formula: C21H23F3N2O MolecularWeight: 376.41533

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

C1CCCN(CC1)CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C21H23F3N2O/c22-21(23,24)18-7-3-4-8-19(18)25-20(27)17-11-9-16(10-12-17)15-26-13-5-1-2-6-14-26/h3-4,7-12H,1-2,5-6,13-15H2,(H,25,27)