4-(2-ethylphenyl)-2-[(1-oxidanyl-1-oxidanylidene-propan-2-yl)amino]butanoic acid

Systemtic Name: 4-(2-ethylphenyl)-2-[(1-oxidanyl-1-oxidanylidene-propan-2-yl)amino]butanoic acid Openeye Name: 4-(2-ethylphenyl)-2-[(2-hydroxy-1-methyl-2-oxo-ethyl)amino]butanoic acid CAS Name: 4-(2-ethylphenyl)-2-[(1-hydroxy-1-oxopropan-2-yl)amino]butanoic acid IUPAC Name: 4-(2-ethylphenyl)-2-[(1-hydroxy-1-oxopropan-2-yl)amino]butanoic acid Traditional Name: 4-(2-ethylphenyl)-2-[(2-hydroxy-2-keto-1-methyl-ethyl)amino]butyric acid Formula: C15H21NO4 MolecularWeight: 279.33154

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1CCC(C(=O)O)NC(C)C(=O)O

Isomeric SMILES

CCC1=CC=CC=C1CCC(C(=O)O)NC(C)C(=O)O

InChI

InChI=1S/C15H21NO4/c1-3-11-6-4-5-7-12(11)8-9-13(15(19)20)16-10(2)14(17)18/h4-7,10,13,16H,3,8-9H2,1-2H3,(H,17,18)(H,19,20)