potassium 2-[(3-fluoranyl-2,3-dimethyl-4-oxidanylidene-butanoyl)amino]-3-(4-methylphenyl)propanoic acid

Systemtic Name: potassium 2-[(3-fluoranyl-2,3-dimethyl-4-oxidanylidene-butanoyl)amino]-3-(4-methylphenyl)propanoic acid Openeye Name: potassium 2-[(3-fluoro-2,3-dimethyl-4-oxo-butanoyl)amino]-3-(p-tolyl)propanoic acid CAS Name: potassium 2-[(3-fluoro-2,3-dimethyl-1,4-dioxobutyl)amino]-3-(4-methylphenyl)propanoic acid IUPAC Name: potassium 2-[(3-fluoro-2,3-dimethyl-4-oxobutanoyl)amino]-3-(4-methylphenyl)propanoic acid Traditional Name: potassium 2-[(3-fluoro-4-keto-2,3-dimethyl-butanoyl)amino]-3-(p-tolyl)propionic acid Formula: C16H19FKNO4 MolecularWeight: 347.423063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(C(=O)O)NC(=O)C(C)C(C)([C-]=O)F.[K+]

Isomeric SMILES

CC1=CC=C(C=C1)CC(C(=O)O)NC(=O)C(C)C(C)([C-]=O)F.[K+]

InChI

InChI=1S/C16H19FNO4.K/c1-10-4-6-12(7-5-10)8-13(15(21)22)18-14(20)11(2)16(3,17)9-19;/h4-7,11,13H,8H2,1-3H3,(H,18,20)(H,21,22);/q-1;+1