5-[(5-fluoranyl-2-methyl-phenyl)amino]-3,3-dimethyl-5-oxidanylidene-pentanoate

Systemtic Name: 5-[(5-fluoranyl-2-methyl-phenyl)amino]-3,3-dimethyl-5-oxidanylidene-pentanoate Openeye Name: 5-(5-fluoro-2-methyl-anilino)-3,3-dimethyl-5-oxo-pentanoate CAS Name: 5-(5-fluoro-2-methylanilino)-3,3-dimethyl-5-oxopentanoate IUPAC Name: 5-(5-fluoro-2-methylanilino)-3,3-dimethyl-5-oxopentanoate Traditional Name: 5-(5-fluoro-2-methyl-anilino)-5-keto-3,3-dimethyl-valerate Formula: C14H17FNO3- MolecularWeight: 266.288083

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18FNO3/c1-9-4-5-10(15)6-11(9)16-12(17)7-14(2,3)8-13(18)19/h4-6H,7-8H2,1-3H3,(H,16,17)(H,18,19)/p-1