3-methyl-2-[[2-[(4-methylphenyl)methylamino]-2-oxidanylidene-ethyl]amino]butanoic acid

Systemtic Name: 3-methyl-2-[[2-[(4-methylphenyl)methylamino]-2-oxidanylidene-ethyl]amino]butanoic acid Openeye Name: 3-methyl-2-[[2-oxo-2-(p-tolylmethylamino)ethyl]amino]butanoic acid CAS Name: 3-methyl-2-[[2-[(4-methylphenyl)methylamino]-2-oxoethyl]amino]butanoic acid IUPAC Name: 3-methyl-2-[[2-[(4-methylphenyl)methylamino]-2-oxoethyl]amino]butanoic acid Traditional Name: 2-[[2-keto-2-[(4-methylbenzyl)amino]ethyl]amino]-3-methyl-butyric acid Formula: C15H22N2O3 MolecularWeight: 278.34678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)CNC(C(C)C)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)CNC(C(C)C)C(=O)O

InChI

InChI=1S/C15H22N2O3/c1-10(2)14(15(19)20)17-9-13(18)16-8-12-6-4-11(3)5-7-12/h4-7,10,14,17H,8-9H2,1-3H3,(H,16,18)(H,19,20)