(2R)-2-[(2,5-dimethylphenyl)carbonylamino]-3-(1H-imidazol-5-yl)propanoate

Systemtic Name: (2R)-2-[(2,5-dimethylphenyl)carbonylamino]-3-(1H-imidazol-5-yl)propanoate Openeye Name: (2R)-2-[(2,5-dimethylbenzoyl)amino]-3-(1H-imidazol-5-yl)propanoate CAS Name: (2R)-2-[[(2,5-dimethylphenyl)-oxomethyl]amino]-3-(1H-imidazol-5-yl)propanoate IUPAC Name: (2R)-2-[(2,5-dimethylbenzoyl)amino]-3-(1H-imidazol-5-yl)propanoate Traditional Name: (2R)-2-[(2,5-dimethylbenzoyl)amino]-3-(1H-imidazol-5-yl)propionate Formula: C15H16N3O3- MolecularWeight: 286.30584

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17N3O3/c1-9-3-4-10(2)12(5-9)14(19)18-13(15(20)21)6-11-7-16-8-17-11/h3-5,7-8,13H,6H2,1-2H3,(H,16,17)(H,18,19)(H,20,21)/p-1/t13-/m1/s1