(2S)-2-[(5-azanyl-1,2,4-triazol-1-yl)methyl]butanedioate

Systemtic Name: (2S)-2-[(5-azanyl-1,2,4-triazol-1-yl)methyl]butanedioate Openeye Name: (2S)-2-[(5-amino-1,2,4-triazol-1-yl)methyl]butanedioate CAS Name: (2S)-2-[(5-amino-1,2,4-triazol-1-yl)methyl]butanedioate IUPAC Name: (2S)-2-[(5-amino-1,2,4-triazol-1-yl)methyl]butanedioate Traditional Name: (2S)-2-[(5-amino-1,2,4-triazol-1-yl)methyl]succinate Formula: C7H8N4O4-2 MolecularWeight: 212.16282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=NN(C(=N1)N)CC(CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=NN(C(=N1)N)C[C@H](CC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C7H10N4O4/c8-7-9-3-10-11(7)2-4(6(14)15)1-5(12)13/h3-4H,1-2H2,(H,12,13)(H,14,15)(H2,8,9,10)/p-2/t4-/m0/s1