N-(5-bromanyl-2-piperazin-1-yl-phenyl)naphthalene-1-carboxamide; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: N-(5-bromanyl-2-piperazin-1-yl-phenyl)naphthalene-1-carboxamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: N-(5-bromo-2-piperazin-1-yl-phenyl)naphthalene-1-carboxamide; 2,2,2-trifluoroacetic acid CAS Name: N-[5-bromo-2-(1-piperazinyl)phenyl]-1-naphthalenecarboxamide; 2,2,2-trifluoroacetic acid IUPAC Name: N-(5-bromo-2-piperazin-1-ylphenyl)naphthalene-1-carboxamide; 2,2,2-trifluoroacetic acid Traditional Name: N-(5-bromo-2-piperazino-phenyl)-1-naphthamide; 2,2,2-trifluoroacetic acid Formula: C23H21BrF3N3O3 MolecularWeight: 524.33035

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=C(C=C(C=C2)Br)NC(=O)C3=CC=CC4=CC=CC=C43.C(=O)(C(F)(F)F)O

Isomeric SMILES

C1CN(CCN1)C2=C(C=C(C=C2)Br)NC(=O)C3=CC=CC4=CC=CC=C43.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C21H20BrN3O.C2HF3O2/c22-16-8-9-20(25-12-10-23-11-13-25)19(14-16)24-21(26)18-7-3-5-15-4-1-2-6-17(15)18;3-2(4,5)1(6)7/h1-9,14,23H,10-13H2,(H,24,26);(H,6,7)