(2R)-3-(1H-imidazol-5-yl)-2-[(4-methylphenyl)carbonylamino]propanoic acid

Systemtic Name: (2R)-3-(1H-imidazol-5-yl)-2-[(4-methylphenyl)carbonylamino]propanoic acid Openeye Name: (2R)-3-(1H-imidazol-5-yl)-2-[(4-methylbenzoyl)amino]propanoic acid CAS Name: (2R)-3-(1H-imidazol-5-yl)-2-[[(4-methylphenyl)-oxomethyl]amino]propanoic acid IUPAC Name: (2R)-3-(1H-imidazol-5-yl)-2-[(4-methylbenzoyl)amino]propanoic acid Traditional Name: (2R)-3-(1H-imidazol-5-yl)-2-(p-toluoylamino)propionic acid Formula: C14H15N3O3 MolecularWeight: 273.2872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(CC2=CN=CN2)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N[C@H](CC2=CN=CN2)C(=O)O

InChI

InChI=1S/C14H15N3O3/c1-9-2-4-10(5-3-9)13(18)17-12(14(19)20)6-11-7-15-8-16-11/h2-5,7-8,12H,6H2,1H3,(H,15,16)(H,17,18)(H,19,20)/t12-/m1/s1