2-[[4-(1,2,4-triazol-1-yl)phenyl]methylamino]ethanoic acid

Systemtic Name: 2-[[4-(1,2,4-triazol-1-yl)phenyl]methylamino]ethanoic acid Openeye Name: 2-[[4-(1,2,4-triazol-1-yl)phenyl]methylamino]acetic acid CAS Name: 2-[[4-(1,2,4-triazol-1-yl)phenyl]methylamino]acetic acid IUPAC Name: 2-[[4-(1,2,4-triazol-1-yl)phenyl]methylamino]acetic acid Traditional Name: 2-[[4-(1,2,4-triazol-1-yl)benzyl]amino]acetic acid Formula: C11H12N4O2 MolecularWeight: 232.23858

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNCC(=O)O)N2C=NC=N2

Isomeric SMILES

C1=CC(=CC=C1CNCC(=O)O)N2C=NC=N2

InChI

InChI=1S/C11H12N4O2/c16-11(17)6-12-5-9-1-3-10(4-2-9)15-8-13-7-14-15/h1-4,7-8,12H,5-6H2,(H,16,17)