2-[2-carboxyethyl(phenyl)amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[2-carboxyethyl(phenyl)amino]-4-methyl-pentanoic acid Openeye Name: 2-[N-(2-carboxyethyl)anilino]-4-methyl-pentanoic acid CAS Name: 2-[N-(2-carboxyethyl)anilino]-4-methylpentanoic acid IUPAC Name: 2-[N-(2-carboxyethyl)anilino]-4-methylpentanoic acid Traditional Name: 2-[N-(2-carboxyethyl)anilino]-4-methyl-valeric acid Formula: C15H21NO4 MolecularWeight: 279.33154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21NO4/c1-11(2)10-13(15(19)20)16(9-8-14(17)18)12-6-4-3-5-7-12/h3-7,11,13H,8-10H2,1-2H3,(H,17,18)(H,19,20)