2-azanyl-6-phenyl-2-(trifluoromethyl)hex-5-ynoic acid

Systemtic Name: 2-azanyl-6-phenyl-2-(trifluoromethyl)hex-5-ynoic acid Openeye Name: 2-amino-6-phenyl-2-(trifluoromethyl)hex-5-ynoic acid CAS Name: 2-amino-6-phenyl-2-(trifluoromethyl)-5-hexynoic acid IUPAC Name: 2-amino-6-phenyl-2-(trifluoromethyl)hex-5-ynoic acid Traditional Name: 2-amino-6-phenyl-2-(trifluoromethyl)hex-5-ynoic acid Formula: C13H12F3NO2 MolecularWeight: 271.23509

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CCCC(C(=O)O)(C(F)(F)F)N

Isomeric SMILES

C1=CC=C(C=C1)C#CCCC(C(=O)O)(C(F)(F)F)N

InChI

InChI=1S/C13H12F3NO2/c14-13(15,16)12(17,11(18)19)9-5-4-8-10-6-2-1-3-7-10/h1-3,6-7H,5,9,17H2,(H,18,19)