(2S)-4-(4-methylphenyl)-2-[[(2R)-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]butanoic acid

Systemtic Name: (2S)-4-(4-methylphenyl)-2-[[(2R)-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]butanoic acid Openeye Name: (2S)-2-[[(1R)-2-hydroxy-1-methyl-2-oxo-ethyl]amino]-4-(p-tolyl)butanoic acid CAS Name: (2S)-2-[[(2R)-1-hydroxy-1-oxopropan-2-yl]amino]-4-(4-methylphenyl)butanoic acid IUPAC Name: (2S)-2-[[(2R)-1-hydroxy-1-oxopropan-2-yl]amino]-4-(4-methylphenyl)butanoic acid Traditional Name: (2S)-2-[[(1R)-2-hydroxy-2-keto-1-methyl-ethyl]amino]-4-(p-tolyl)butyric acid Formula: C14H19NO4 MolecularWeight: 265.30496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO4/c1-9-3-5-11(6-4-9)7-8-12(14(18)19)15-10(2)13(16)17/h3-6,10,12,15H,7-8H2,1-2H3,(H,16,17)(H,18,19)/t10-,12+/m1/s1