2-[5-(azepan-1-ylmethyl)-1,2,3,4-tetrazol-1-yl]ethanoic acid

Systemtic Name: 2-[5-(azepan-1-ylmethyl)-1,2,3,4-tetrazol-1-yl]ethanoic acid Openeye Name: 2-[5-(azepan-1-ylmethyl)tetrazol-1-yl]acetic acid CAS Name: 2-[5-(1-azepanylmethyl)-1-tetrazolyl]acetic acid IUPAC Name: 2-[5-(azepan-1-ylmethyl)tetrazol-1-yl]acetic acid Traditional Name: 2-[5-(azepan-1-ylmethyl)tetrazol-1-yl]acetic acid Formula: C10H17N5O2 MolecularWeight: 239.27428

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC2=NN=NN2CC(=O)O

Isomeric SMILES

C1CCCN(CC1)CC2=NN=NN2CC(=O)O

InChI

InChI=1S/C10H17N5O2/c16-10(17)8-15-9(11-12-13-15)7-14-5-3-1-2-4-6-14/h1-8H2,(H,16,17)