(3R)-5-[[3,5-bis(trifluoromethyl)phenyl]amino]-3-methyl-5-oxidanylidene-pentanoate

Systemtic Name: (3R)-5-[[3,5-bis(trifluoromethyl)phenyl]amino]-3-methyl-5-oxidanylidene-pentanoate Openeye Name: (3R)-5-[3,5-bis(trifluoromethyl)anilino]-3-methyl-5-oxo-pentanoate CAS Name: (3R)-5-[3,5-bis(trifluoromethyl)anilino]-3-methyl-5-oxopentanoate IUPAC Name: (3R)-5-[3,5-bis(trifluoromethyl)anilino]-3-methyl-5-oxopentanoate Traditional Name: (3R)-5-[3,5-bis(trifluoromethyl)anilino]-5-keto-3-methyl-valerate Formula: C14H12F6NO3- MolecularWeight: 356.240399

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CC(=O)[O-]

Isomeric SMILES

C[C@H](CC(=O)NC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)CC(=O)[O-]

InChI

InChI=1S/C14H13F6NO3/c1-7(3-12(23)24)2-11(22)21-10-5-8(13(15,16)17)4-9(6-10)14(18,19)20/h4-7H,2-3H2,1H3,(H,21,22)(H,23,24)/p-1/t7-/m1/s1