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

Systemtic Name: 4-[(1-phenyl-1,2,3-triazol-4-yl)carbonylamino]butanoic acid Openeye Name: 4-[(1-phenyltriazole-4-carbonyl)amino]butanoic acid CAS Name: 4-[[oxo-(1-phenyl-4-triazolyl)methyl]amino]butanoic acid IUPAC Name: 4-[(1-phenyltriazole-4-carbonyl)amino]butanoic acid Traditional Name: 4-[(1-phenyltriazole-4-carbonyl)amino]butyric acid Formula: C13H14N4O3 MolecularWeight: 274.27526

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N4O3/c18-12(19)7-4-8-14-13(20)11-9-17(16-15-11)10-5-2-1-3-6-10/h1-3,5-6,9H,4,7-8H2,(H,14,20)(H,18,19)