(2S)-2-[(2,5-dimethylphenyl)carbonylamino]-3-methyl-butanoic acid

Systemtic Name: (2S)-2-[(2,5-dimethylphenyl)carbonylamino]-3-methyl-butanoic acid Openeye Name: (2S)-2-[(2,5-dimethylbenzoyl)amino]-3-methyl-butanoic acid CAS Name: (2S)-2-[[(2,5-dimethylphenyl)-oxomethyl]amino]-3-methylbutanoic acid IUPAC Name: (2S)-2-[(2,5-dimethylbenzoyl)amino]-3-methylbutanoic acid Traditional Name: (2S)-2-[(2,5-dimethylbenzoyl)amino]-3-methyl-butyric acid Formula: C14H19NO3 MolecularWeight: 249.30556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)NC(C(C)C)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)N[C@@H](C(C)C)C(=O)O

InChI

InChI=1S/C14H19NO3/c1-8(2)12(14(17)18)15-13(16)11-7-9(3)5-6-10(11)4/h5-8,12H,1-4H3,(H,15,16)(H,17,18)/t12-/m0/s1