4-[(2,6-dimethylphenyl)amino]-2-(4-fluorophenyl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(2,6-dimethylphenyl)amino]-2-(4-fluorophenyl)-4-oxidanylidene-butanoic acid Openeye Name: 4-(2,6-dimethylanilino)-2-(4-fluorophenyl)-4-oxo-butanoic acid CAS Name: 4-(2,6-dimethylanilino)-2-(4-fluorophenyl)-4-oxobutanoic acid IUPAC Name: 4-(2,6-dimethylanilino)-2-(4-fluorophenyl)-4-oxobutanoic acid Traditional Name: 4-(2,6-dimethylanilino)-2-(4-fluorophenyl)-4-keto-butyric acid Formula: C18H18FNO3 MolecularWeight: 315.338823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CC(C2=CC=C(C=C2)F)C(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CC(C2=CC=C(C=C2)F)C(=O)O

InChI

InChI=1S/C18H18FNO3/c1-11-4-3-5-12(2)17(11)20-16(21)10-15(18(22)23)13-6-8-14(19)9-7-13/h3-9,15H,10H2,1-2H3,(H,20,21)(H,22,23)