2-[2-carboxyethyl-(phenylmethyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 2-[2-carboxyethyl-(phenylmethyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 2-[benzyl(2-carboxyethyl)amino]-4-oxo-butanoic acid CAS Name: 2-[2-carboxyethyl-(phenylmethyl)amino]-4-oxobutanoic acid IUPAC Name: 2-[benzyl(2-carboxyethyl)amino]-4-oxobutanoic acid Traditional Name: 2-[benzyl(2-carboxyethyl)amino]-4-keto-butyric acid Formula: C14H17NO5 MolecularWeight: 279.28848

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCC(=O)O)C(CC=O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN(CCC(=O)O)C(CC=O)C(=O)O

InChI

InChI=1S/C14H17NO5/c16-9-7-12(14(19)20)15(8-6-13(17)18)10-11-4-2-1-3-5-11/h1-5,9,12H,6-8,10H2,(H,17,18)(H,19,20)