2-chloranyl-N-[3-(trifluoromethyl)phenyl]ethanamide hydrate

Systemtic Name: 2-chloranyl-N-[3-(trifluoromethyl)phenyl]ethanamide hydrate Openeye Name: 2-chloro-N-[3-(trifluoromethyl)phenyl]acetamide hydrate CAS Name: 2-chloro-N-[3-(trifluoromethyl)phenyl]acetamide hydrate IUPAC Name: 2-chloro-N-[3-(trifluoromethyl)phenyl]acetamide hydrate Traditional Name: 2-chloro-N-[3-(trifluoromethyl)phenyl]acetamide hydrate Formula: C9H9ClF3NO2 MolecularWeight: 255.62147

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CCl)C(F)(F)F.O

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CCl)C(F)(F)F.O

InChI

InChI=1S/C9H7ClF3NO.H2O/c10-5-8(15)14-7-3-1-2-6(4-7)9(11,12)13;/h1-4H,5H2,(H,14,15);1H2