(2,6-dimethylphenyl) (2S)-2-[(2-fluorophenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: (2,6-dimethylphenyl) (2S)-2-[(2-fluorophenyl)carbonylamino]-3-methyl-butanoate Openeye Name: (2,6-dimethylphenyl) (2S)-2-[(2-fluorobenzoyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(2-fluorophenyl)-oxomethyl]amino]-3-methylbutanoic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) (2S)-2-[(2-fluorobenzoyl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[(2-fluorobenzoyl)amino]-3-methyl-butyric acid (2,6-dimethylphenyl) ester Formula: C20H22FNO3 MolecularWeight: 343.391983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OC(=O)C(C(C)C)NC(=O)C2=CC=CC=C2F

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC(=O)[C@H](C(C)C)NC(=O)C2=CC=CC=C2F

InChI

InChI=1S/C20H22FNO3/c1-12(2)17(22-19(23)15-10-5-6-11-16(15)21)20(24)25-18-13(3)8-7-9-14(18)4/h5-12,17H,1-4H3,(H,22,23)/t17-/m0/s1