2-azanyl-3-[1-(4-methylphenyl)carbonylimidazol-4-yl]propanoic acid

Systemtic Name: 2-azanyl-3-[1-(4-methylphenyl)carbonylimidazol-4-yl]propanoic acid Openeye Name: 2-amino-3-[1-(4-methylbenzoyl)imidazol-4-yl]propanoic acid CAS Name: 2-amino-3-[1-[(4-methylphenyl)-oxomethyl]-4-imidazolyl]propanoic acid IUPAC Name: 2-amino-3-[1-(4-methylbenzoyl)imidazol-4-yl]propanoic acid Traditional Name: 2-amino-3-(1-p-toluoylimidazol-4-yl)propionic acid Formula: C14H15N3O3 MolecularWeight: 273.2872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2C=C(N=C2)CC(C(=O)O)N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2C=C(N=C2)CC(C(=O)O)N

InChI

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