(2R)-3-(4-azanyl-5-phenyl-1,2,4-triazol-3-yl)-2-methyl-propanoate

Systemtic Name: (2R)-3-(4-azanyl-5-phenyl-1,2,4-triazol-3-yl)-2-methyl-propanoate Openeye Name: (2R)-3-(4-amino-5-phenyl-1,2,4-triazol-3-yl)-2-methyl-propanoate CAS Name: (2R)-3-(4-amino-5-phenyl-1,2,4-triazol-3-yl)-2-methylpropanoate IUPAC Name: (2R)-3-(4-amino-5-phenyl-1,2,4-triazol-3-yl)-2-methylpropanoate Traditional Name: (2R)-3-(4-amino-5-phenyl-1,2,4-triazol-3-yl)-2-methyl-propionate Formula: C12H13N4O2- MolecularWeight: 245.25722

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=NN=C(N1N)C2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

C[C@H](CC1=NN=C(N1N)C2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C12H14N4O2/c1-8(12(17)18)7-10-14-15-11(16(10)13)9-5-3-2-4-6-9/h2-6,8H,7,13H2,1H3,(H,17,18)/p-1/t8-/m1/s1