azepan-2-one; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: azepan-2-one; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: azepan-2-one; 2,2,2-trifluoroacetic acid CAS Name: 2-azepanone; 2,2,2-trifluoroacetic acid IUPAC Name: azepan-2-one; 2,2,2-trifluoroacetic acid Traditional Name: azepan-2-one; 2,2,2-trifluoroacetic acid Formula: C8H12F3NO3 MolecularWeight: 227.18099

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)NCC1.C(=O)(C(F)(F)F)O

Isomeric SMILES

C1CCC(=O)NCC1.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C6H11NO.C2HF3O2/c8-6-4-2-1-3-5-7-6;3-2(4,5)1(6)7/h1-5H2,(H,7,8);(H,6,7)