2-azanyl-4-[3,4-bis(fluoranyl)phenyl]-4-oxidanylidene-butanoic acid hydrochloride

Systemtic Name: 2-azanyl-4-[3,4-bis(fluoranyl)phenyl]-4-oxidanylidene-butanoic acid hydrochloride Openeye Name: 2-amino-4-(3,4-difluorophenyl)-4-oxo-butanoic acid hydrochloride CAS Name: 2-amino-4-(3,4-difluorophenyl)-4-oxobutanoic acid hydrochloride IUPAC Name: 2-amino-4-(3,4-difluorophenyl)-4-oxobutanoic acid hydrochloride Traditional Name: 2-amino-4-(3,4-difluorophenyl)-4-keto-butyric acid hydrochloride Formula: C10H10ClF2NO3 MolecularWeight: 265.641106

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)CC(C(=O)O)N)F)F.Cl

Isomeric SMILES

C1=CC(=C(C=C1C(=O)CC(C(=O)O)N)F)F.Cl

InChI

InChI=1S/C10H9F2NO3.ClH/c11-6-2-1-5(3-7(6)12)9(14)4-8(13)10(15)16;/h1-3,8H,4,13H2,(H,15,16);1H