2-acetyloxy-3-[1-(phenylmethyl)-1,2,3-triazol-4-yl]propanoic acid

Systemtic Name: 2-acetyloxy-3-[1-(phenylmethyl)-1,2,3-triazol-4-yl]propanoic acid Openeye Name: 2-acetoxy-3-(1-benzyltriazol-4-yl)propanoic acid CAS Name: 2-acetyloxy-3-[1-(phenylmethyl)-4-triazolyl]propanoic acid IUPAC Name: 2-acetyloxy-3-(1-benzyltriazol-4-yl)propanoic acid Traditional Name: 2-acetoxy-3-(1-benzyltriazol-4-yl)propionic acid Formula: C14H15N3O4 MolecularWeight: 289.2866

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(CC1=CN(N=N1)CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(=O)OC(CC1=CN(N=N1)CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C14H15N3O4/c1-10(18)21-13(14(19)20)7-12-9-17(16-15-12)8-11-5-3-2-4-6-11/h2-6,9,13H,7-8H2,1H3,(H,19,20)