3-Phenyl-4-(1 H-Tetrazol-5-Ylcarbamoyl)-Butyric Acid
[CAS# 428504-04-5]

Identification

• Name: 3-Phenyl-4-(1 H-Tetrazol-5-Ylcarbamoyl)-Butyric Acid
• Synonyms: (3S)-5-Oxido-3-Phenyl-5-(2H-Tetrazol-5-Ylimino)Valerate; (3S)-5-Oxido-3-Phenyl-5-(2H-1,2,3,4-Tetrazol-5-Ylimino)Pentanoate; Zinc00129682
• Molecular Formula: C₁₂H₁₁N₅O₃
• Molecular Weight: 273.25
• CAS Registry Number: 428504-04-5
• SMILES: [C@@H](CC(=O)[N-]C1=N[NH]N=N1)(C2=CC=CC=C2)CC([O-])=O
• InChI: 1S/C12H13N5O3/c18-10(13-12-14-16-17-15-12)6-9(7-11(19)20)8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H3,13,14,15,16,17,18,19,20)/p-2/t9-/m0/s1
• InChIKey: XKYOGKPSXMFUDH-VIFPVBQESA-L