1H-1-benzazepine-4-carboxylic acid; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 1H-1-benzazepine-4-carboxylic acid; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 1H-1-benzazepine-4-carboxylic acid; 2,2,2-trifluoroacetic acid CAS Name: 1H-1-benzazepine-4-carboxylic acid; 2,2,2-trifluoroacetic acid IUPAC Name: 1H-1-benzazepine-4-carboxylic acid; 2,2,2-trifluoroacetic acid Traditional Name: 1H-1-benzazepine-4-carboxylic acid; 2,2,2-trifluoroacetic acid Formula: C13H10F3NO4 MolecularWeight: 301.21801

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C=CN2)C(=O)O.C(=O)(C(F)(F)F)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C=CN2)C(=O)O.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C11H9NO2.C2HF3O2/c13-11(14)9-5-6-12-10-4-2-1-3-8(10)7-9;3-2(4,5)1(6)7/h1-7,12H,(H,13,14);(H,6,7)