3-[5-(dimethylaminomethyl)-1,2,3,4-tetrazol-1-yl]benzoic acid

Systemtic Name: 3-[5-(dimethylaminomethyl)-1,2,3,4-tetrazol-1-yl]benzoic acid Openeye Name: 3-[5-(dimethylaminomethyl)tetrazol-1-yl]benzoic acid CAS Name: 3-[5-(dimethylaminomethyl)-1-tetrazolyl]benzoic acid IUPAC Name: 3-[5-(dimethylaminomethyl)tetrazol-1-yl]benzoic acid Traditional Name: 3-[5-(dimethylaminomethyl)tetrazol-1-yl]benzoic acid Formula: C11H13N5O2 MolecularWeight: 247.25322

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=NN=NN1C2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CN(C)CC1=NN=NN1C2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C11H13N5O2/c1-15(2)7-10-12-13-14-16(10)9-5-3-4-8(6-9)11(17)18/h3-6H,7H2,1-2H3,(H,17,18)