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

Systemtic Name: 4-[1-(4-dimethylaminophenyl)-5-methyl-1,2,3,4-tetrazol-1-ium-1-yl]butanoic acid Openeye Name: 4-[1-(4-dimethylaminophenyl)-5-methyl-tetrazol-1-ium-1-yl]butanoic acid CAS Name: 4-[1-(4-dimethylaminophenyl)-5-methyl-1-tetrazol-1-iumyl]butanoic acid IUPAC Name: 4-[1-(4-dimethylaminophenyl)-5-methyltetrazol-1-ium-1-yl]butanoic acid Traditional Name: 4-[1-(4-dimethylaminophenyl)-5-methyl-tetrazol-1-ium-1-yl]butyric acid Formula: C14H20N5O2+ MolecularWeight: 290.3409

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=N[N+]1(CCCC(=O)O)C2=CC=C(C=C2)N(C)C

Isomeric SMILES

CC1=NN=N[N+]1(CCCC(=O)O)C2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C14H19N5O2/c1-11-15-16-17-19(11,10-4-5-14(20)21)13-8-6-12(7-9-13)18(2)3/h6-9H,4-5,10H2,1-3H3/p+1