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

Systemtic Name: (2R)-2-[(1,5-dimethylpyrrol-2-yl)carbonylamino]-3-(1H-imidazol-5-yl)propanoic acid Openeye Name: (2R)-2-[(1,5-dimethylpyrrole-2-carbonyl)amino]-3-(1H-imidazol-5-yl)propanoic acid CAS Name: (2R)-2-[[(1,5-dimethyl-2-pyrrolyl)-oxomethyl]amino]-3-(1H-imidazol-5-yl)propanoic acid IUPAC Name: (2R)-2-[(1,5-dimethylpyrrole-2-carbonyl)amino]-3-(1H-imidazol-5-yl)propanoic acid Traditional Name: (2R)-2-[(1,5-dimethylpyrrole-2-carbonyl)amino]-3-(1H-imidazol-5-yl)propionic acid Formula: C13H16N4O3 MolecularWeight: 276.29114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C)C(=O)NC(CC2=CN=CN2)C(=O)O

Isomeric SMILES

CC1=CC=C(N1C)C(=O)N[C@H](CC2=CN=CN2)C(=O)O

InChI

InChI=1S/C13H16N4O3/c1-8-3-4-11(17(8)2)12(18)16-10(13(19)20)5-9-6-14-7-15-9/h3-4,6-7,10H,5H2,1-2H3,(H,14,15)(H,16,18)(H,19,20)/t10-/m1/s1