4-(2-hydroxyethylamino)-4-oxidanylidene-2-(phenylmethyl)butanoic acid

Systemtic Name: 4-(2-hydroxyethylamino)-4-oxidanylidene-2-(phenylmethyl)butanoic acid Openeye Name: 2-benzyl-4-(2-hydroxyethylamino)-4-oxo-butanoic acid CAS Name: 4-(2-hydroxyethylamino)-4-oxo-2-(phenylmethyl)butanoic acid IUPAC Name: 2-benzyl-4-(2-hydroxyethylamino)-4-oxobutanoic acid Traditional Name: 2-benzyl-4-(2-hydroxyethylamino)-4-keto-butyric acid Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CC(=O)NCCO)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC(CC(=O)NCCO)C(=O)O

InChI

InChI=1S/C13H17NO4/c15-7-6-14-12(16)9-11(13(17)18)8-10-4-2-1-3-5-10/h1-5,11,15H,6-9H2,(H,14,16)(H,17,18)