3-(1H-imidazol-5-yl)-2-methyl-2-[(2-methylphenyl)amino]propanoic acid

Systemtic Name: 3-(1H-imidazol-5-yl)-2-methyl-2-[(2-methylphenyl)amino]propanoic acid Openeye Name: 3-(1H-imidazol-5-yl)-2-methyl-2-(2-methylanilino)propanoic acid CAS Name: 3-(1H-imidazol-5-yl)-2-methyl-2-(2-methylanilino)propanoic acid IUPAC Name: 3-(1H-imidazol-5-yl)-2-methyl-2-(2-methylanilino)propanoic acid Traditional Name: 3-(1H-imidazol-5-yl)-2-methyl-2-(o-toluidino)propionic acid Formula: C14H17N3O2 MolecularWeight: 259.30368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(C)(CC2=CN=CN2)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1NC(C)(CC2=CN=CN2)C(=O)O

InChI

InChI=1S/C14H17N3O2/c1-10-5-3-4-6-12(10)17-14(2,13(18)19)7-11-8-15-9-16-11/h3-6,8-9,17H,7H2,1-2H3,(H,15,16)(H,18,19)