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

Systemtic Name: 4-[[3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]carbonylamino]butanoic acid Openeye Name: 4-[[3-(2H-tetrazol-5-yl)benzoyl]amino]butanoic acid CAS Name: 4-[[oxo-[3-(2H-tetrazol-5-yl)phenyl]methyl]amino]butanoic acid IUPAC Name: 4-[[3-(2H-tetrazol-5-yl)benzoyl]amino]butanoic acid Traditional Name: 4-[[3-(2H-tetrazol-5-yl)benzoyl]amino]butyric acid Formula: C12H13N5O3 MolecularWeight: 275.26332

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13N5O3/c18-10(19)5-2-6-13-12(20)9-4-1-3-8(7-9)11-14-16-17-15-11/h1,3-4,7H,2,5-6H2,(H,13,20)(H,18,19)(H,14,15,16,17)