4-[5-methyl-1-(1,3-thiazol-2-yl)-1,2,3,4-tetrazol-1-ium-1-yl]butanoic acid

Systemtic Name: 4-[5-methyl-1-(1,3-thiazol-2-yl)-1,2,3,4-tetrazol-1-ium-1-yl]butanoic acid Openeye Name: 4-(5-methyl-1-thiazol-2-yl-tetrazol-1-ium-1-yl)butanoic acid CAS Name: 4-[5-methyl-1-(2-thiazolyl)-1-tetrazol-1-iumyl]butanoic acid IUPAC Name: 4-[5-methyl-1-(1,3-thiazol-2-yl)tetrazol-1-ium-1-yl]butanoic acid Traditional Name: 4-(5-methyl-1-thiazol-2-yl-tetrazol-1-ium-1-yl)butyric acid Formula: C9H12N5O2S+ MolecularWeight: 254.28888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=N[N+]1(CCCC(=O)O)C2=NC=CS2

Isomeric SMILES

CC1=NN=N[N+]1(CCCC(=O)O)C2=NC=CS2

InChI

InChI=1S/C9H11N5O2S/c1-7-11-12-13-14(7,5-2-3-8(15)16)9-10-4-6-17-9/h4,6H,2-3,5H2,1H3/p+1