N-[2-chloranyl-5-(trifluoromethyl)phenyl]-4-ethanoyl-1,4-diazepane-1-carboxamide

Systemtic Name: N-[2-chloranyl-5-(trifluoromethyl)phenyl]-4-ethanoyl-1,4-diazepane-1-carboxamide Openeye Name: 4-acetyl-N-[2-chloro-5-(trifluoromethyl)phenyl]-1,4-diazepane-1-carboxamide CAS Name: 4-acetyl-N-[2-chloro-5-(trifluoromethyl)phenyl]-1,4-diazepane-1-carboxamide IUPAC Name: 4-acetyl-N-[2-chloro-5-(trifluoromethyl)phenyl]-1,4-diazepane-1-carboxamide Traditional Name: 4-acetyl-N-[2-chloro-5-(trifluoromethyl)phenyl]-1,4-diazepane-1-carboxamide Formula: C15H17ClF3N3O2 MolecularWeight: 363.76259

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCN(CC1)C(=O)NC2=C(C=CC(=C2)C(F)(F)F)Cl

Isomeric SMILES

CC(=O)N1CCCN(CC1)C(=O)NC2=C(C=CC(=C2)C(F)(F)F)Cl

InChI

InChI=1S/C15H17ClF3N3O2/c1-10(23)21-5-2-6-22(8-7-21)14(24)20-13-9-11(15(17,18)19)3-4-12(13)16/h3-4,9H,2,5-8H2,1H3,(H,20,24)