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

Systemtic Name: methyl (2S)-2-[(3-fluorophenyl)carbonylamino]-3-methyl-butanoate Openeye Name: methyl (2S)-2-[(3-fluorobenzoyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(3-fluorophenyl)-oxomethyl]amino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(3-fluorobenzoyl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[(3-fluorobenzoyl)amino]-3-methyl-butyric acid methyl ester Formula: C13H16FNO3 MolecularWeight: 253.269443

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC(=O)C1=CC(=CC=C1)F

Isomeric SMILES

CC(C)[C@@H](C(=O)OC)NC(=O)C1=CC(=CC=C1)F

InChI

InChI=1S/C13H16FNO3/c1-8(2)11(13(17)18-3)15-12(16)9-5-4-6-10(14)7-9/h4-8,11H,1-3H3,(H,15,16)/t11-/m0/s1