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

Systemtic Name: 4-[1-(3-chloranyl-2-methyl-phenyl)-5-methyl-1,2,3,4-tetrazol-1-ium-1-yl]butanoic acid Openeye Name: 4-[1-(3-chloro-2-methyl-phenyl)-5-methyl-tetrazol-1-ium-1-yl]butanoic acid CAS Name: 4-[1-(3-chloro-2-methylphenyl)-5-methyl-1-tetrazol-1-iumyl]butanoic acid IUPAC Name: 4-[1-(3-chloro-2-methylphenyl)-5-methyltetrazol-1-ium-1-yl]butanoic acid Traditional Name: 4-[1-(3-chloro-2-methyl-phenyl)-5-methyl-tetrazol-1-ium-1-yl]butyric acid Formula: C13H16ClN4O2+ MolecularWeight: 295.74474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)[N+]2(C(=NN=N2)C)CCCC(=O)O

Isomeric SMILES

CC1=C(C=CC=C1Cl)[N+]2(C(=NN=N2)C)CCCC(=O)O

InChI

InChI=1S/C13H15ClN4O2/c1-9-11(14)5-3-6-12(9)18(8-4-7-13(19)20)10(2)15-16-17-18/h3,5-6H,4,7-8H2,1-2H3/p+1