N-(1H-1-benzazepin-3-yl)propanamide; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: N-(1H-1-benzazepin-3-yl)propanamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: N-(1H-1-benzazepin-3-yl)propanamide; 2,2,2-trifluoroacetic acid CAS Name: N-(1H-1-benzazepin-3-yl)propanamide; 2,2,2-trifluoroacetic acid IUPAC Name: N-(1H-1-benzazepin-3-yl)propanamide; 2,2,2-trifluoroacetic acid Traditional Name: N-(1H-1-benzazepin-3-yl)propionamide; 2,2,2-trifluoroacetic acid Formula: C15H15F3N2O3 MolecularWeight: 328.28641

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CNC2=CC=CC=C2C=C1.C(=O)(C(F)(F)F)O

Isomeric SMILES

CCC(=O)NC1=CNC2=CC=CC=C2C=C1.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C13H14N2O.C2HF3O2/c1-2-13(16)15-11-8-7-10-5-3-4-6-12(10)14-9-11;3-2(4,5)1(6)7/h3-9,14H,2H2,1H3,(H,15,16);(H,6,7)