4-(4-ethyl-1,2,3,4-tetrazol-4-ium-1-yl)benzenesulfonic acid

Systemtic Name: 4-(4-ethyl-1,2,3,4-tetrazol-4-ium-1-yl)benzenesulfonic acid Openeye Name: 4-(4-ethyltetrazol-4-ium-1-yl)benzenesulfonic acid CAS Name: 4-(4-ethyl-1-tetrazol-4-iumyl)benzenesulfonic acid IUPAC Name: 4-(4-ethyltetrazol-4-ium-1-yl)benzenesulfonic acid Traditional Name: 4-(4-ethyltetrazol-4-ium-1-yl)besylic acid Formula: C9H11N4O3S+ MolecularWeight: 255.27364

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CN(N=N1)C2=CC=C(C=C2)S(=O)(=O)O

Isomeric SMILES

CC[N+]1=CN(N=N1)C2=CC=C(C=C2)S(=O)(=O)O

InChI

InChI=1S/C9H10N4O3S/c1-2-12-7-13(11-10-12)8-3-5-9(6-4-8)17(14,15)16/h3-7H,2H2,1H3/p+1