(3,5-dimethylphenyl)methyl 2-[(2-fluorophenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: (3,5-dimethylphenyl)methyl 2-[(2-fluorophenyl)carbonylamino]-3-methyl-butanoate Openeye Name: (3,5-dimethylphenyl)methyl 2-[(2-fluorobenzoyl)amino]-3-methyl-butanoate CAS Name: 2-[[(2-fluorophenyl)-oxomethyl]amino]-3-methylbutanoic acid (3,5-dimethylphenyl)methyl ester IUPAC Name: (3,5-dimethylphenyl)methyl 2-[(2-fluorobenzoyl)amino]-3-methylbutanoate Traditional Name: 2-[(2-fluorobenzoyl)amino]-3-methyl-butyric acid (3,5-dimethylbenzyl) ester Formula: C21H24FNO3 MolecularWeight: 357.418563

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24FNO3/c1-13(2)19(23-20(24)17-7-5-6-8-18(17)22)21(25)26-12-16-10-14(3)9-15(4)11-16/h5-11,13,19H,12H2,1-4H3,(H,23,24)