2-methyl-4-oxidanylidene-4-(phenethylamino)butanoic acid

Systemtic Name: 2-methyl-4-oxidanylidene-4-(phenethylamino)butanoic acid Openeye Name: 2-methyl-4-oxo-4-(phenethylamino)butanoic acid CAS Name: 2-methyl-4-oxo-4-(phenethylamino)butanoic acid IUPAC Name: 2-methyl-4-oxo-4-(phenethylamino)butanoic acid Traditional Name: 4-keto-2-methyl-4-(phenethylamino)butyric acid Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NCCC1=CC=CC=C1)C(=O)O

Isomeric SMILES

CC(CC(=O)NCCC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C13H17NO3/c1-10(13(16)17)9-12(15)14-8-7-11-5-3-2-4-6-11/h2-6,10H,7-9H2,1H3,(H,14,15)(H,16,17)