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

Systemtic Name: 2-[(3,4-dimethylphenyl)carbonylamino]-3-(1H-imidazol-5-yl)propanoic acid Openeye Name: 2-[(3,4-dimethylbenzoyl)amino]-3-(1H-imidazol-5-yl)propanoic acid CAS Name: 2-[[(3,4-dimethylphenyl)-oxomethyl]amino]-3-(1H-imidazol-5-yl)propanoic acid IUPAC Name: 2-[(3,4-dimethylbenzoyl)amino]-3-(1H-imidazol-5-yl)propanoic acid Traditional Name: 2-[(3,4-dimethylbenzoyl)amino]-3-(1H-imidazol-5-yl)propionic acid Formula: C15H17N3O3 MolecularWeight: 287.31378

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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