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

Systemtic Name: (2S)-2-[[(2R)-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]-4-(4-propylphenyl)butanoic acid Openeye Name: (2S)-2-[[(1R)-2-hydroxy-1-methyl-2-oxo-ethyl]amino]-4-(4-propylphenyl)butanoic acid CAS Name: (2S)-2-[[(2R)-1-hydroxy-1-oxopropan-2-yl]amino]-4-(4-propylphenyl)butanoic acid IUPAC Name: (2S)-2-[[(2R)-1-hydroxy-1-oxopropan-2-yl]amino]-4-(4-propylphenyl)butanoic acid Traditional Name: (2S)-2-[[(1R)-2-hydroxy-2-keto-1-methyl-ethyl]amino]-4-(4-propylphenyl)butyric acid Formula: C16H23NO4 MolecularWeight: 293.35812

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)CCC(C(=O)O)NC(C)C(=O)O

Isomeric SMILES

CCCC1=CC=C(C=C1)CC[C@@H](C(=O)O)N[C@H](C)C(=O)O

InChI

InChI=1S/C16H23NO4/c1-3-4-12-5-7-13(8-6-12)9-10-14(16(20)21)17-11(2)15(18)19/h5-8,11,14,17H,3-4,9-10H2,1-2H3,(H,18,19)(H,20,21)/t11-,14+/m1/s1