3-[(1-phenyl-1,2,3-triazol-4-yl)carbonylamino]propanoic acid

Systemtic Name: 3-[(1-phenyl-1,2,3-triazol-4-yl)carbonylamino]propanoic acid Openeye Name: 3-[(1-phenyltriazole-4-carbonyl)amino]propanoic acid CAS Name: 3-[[oxo-(1-phenyl-4-triazolyl)methyl]amino]propanoic acid IUPAC Name: 3-[(1-phenyltriazole-4-carbonyl)amino]propanoic acid Traditional Name: 3-[(1-phenyltriazole-4-carbonyl)amino]propionic acid Formula: C12H12N4O3 MolecularWeight: 260.24868

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(N=N2)C(=O)NCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(N=N2)C(=O)NCCC(=O)O

InChI

InChI=1S/C12H12N4O3/c17-11(18)6-7-13-12(19)10-8-16(15-14-10)9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H,13,19)(H,17,18)