2-[[1-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[1-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[5-phenyl-1-(p-tolyl)-1,2,4-triazole-3-carbonyl]amino]acetic acid CAS Name: 2-[[[1-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[1-(4-methylphenyl)-5-phenyl-1,2,4-triazole-3-carbonyl]amino]acetic acid Traditional Name: 2-[[5-phenyl-1-(p-tolyl)-1,2,4-triazole-3-carbonyl]amino]acetic acid Formula: C18H16N4O3 MolecularWeight: 336.34464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NC(=N2)C(=O)NCC(=O)O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NC(=N2)C(=O)NCC(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C18H16N4O3/c1-12-7-9-14(10-8-12)22-17(13-5-3-2-4-6-13)20-16(21-22)18(25)19-11-15(23)24/h2-10H,11H2,1H3,(H,19,25)(H,23,24)