4-oxidanylidene-2-(2-oxidanylpropylamino)-4-phenylazanyl-butanoic acid

Systemtic Name: 4-oxidanylidene-2-(2-oxidanylpropylamino)-4-phenylazanyl-butanoic acid Openeye Name: 4-anilino-2-(2-hydroxypropylamino)-4-oxo-butanoic acid CAS Name: 4-anilino-2-(2-hydroxypropylamino)-4-oxobutanoic acid IUPAC Name: 4-anilino-2-(2-hydroxypropylamino)-4-oxobutanoic acid Traditional Name: 4-anilino-2-(2-hydroxypropylamino)-4-keto-butyric acid Formula: C13H18N2O4 MolecularWeight: 266.29302

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(CC(=O)NC1=CC=CC=C1)C(=O)O)O

Isomeric SMILES

CC(CNC(CC(=O)NC1=CC=CC=C1)C(=O)O)O

InChI

InChI=1S/C13H18N2O4/c1-9(16)8-14-11(13(18)19)7-12(17)15-10-5-3-2-4-6-10/h2-6,9,11,14,16H,7-8H2,1H3,(H,15,17)(H,18,19)