3-methyl-2-[[3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]carbonylamino]butanoic acid

Systemtic Name: 3-methyl-2-[[3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]carbonylamino]butanoic acid Openeye Name: 3-methyl-2-[[3-(2H-tetrazol-5-yl)benzoyl]amino]butanoic acid CAS Name: 3-methyl-2-[[oxo-[3-(2H-tetrazol-5-yl)phenyl]methyl]amino]butanoic acid IUPAC Name: 3-methyl-2-[[3-(2H-tetrazol-5-yl)benzoyl]amino]butanoic acid Traditional Name: 3-methyl-2-[[3-(2H-tetrazol-5-yl)benzoyl]amino]butyric acid Formula: C13H15N5O3 MolecularWeight: 289.2899

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)C1=CC=CC(=C1)C2=NNN=N2

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)C1=CC=CC(=C1)C2=NNN=N2

InChI

InChI=1S/C13H15N5O3/c1-7(2)10(13(20)21)14-12(19)9-5-3-4-8(6-9)11-15-17-18-16-11/h3-7,10H,1-2H3,(H,14,19)(H,20,21)(H,15,16,17,18)