ethanoic acid; 1-methyl-4-(2H-1,2,3,4-tetrazol-5-ylmethyl)piperazine

Systemtic Name: ethanoic acid; 1-methyl-4-(2H-1,2,3,4-tetrazol-5-ylmethyl)piperazine Openeye Name: acetic acid; 1-methyl-4-(2H-tetrazol-5-ylmethyl)piperazine CAS Name: acetic acid; 1-methyl-4-(2H-tetrazol-5-ylmethyl)piperazine IUPAC Name: acetic acid; 1-methyl-4-(2H-tetrazol-5-ylmethyl)piperazine Traditional Name: acetic acid; 1-methyl-4-(2H-tetrazol-5-ylmethyl)piperazine Formula: C9H18N6O2 MolecularWeight: 242.27822

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.CN1CCN(CC1)CC2=NNN=N2

Isomeric SMILES

CC(=O)O.CN1CCN(CC1)CC2=NNN=N2

InChI

InChI=1S/C7H14N6.C2H4O2/c1-12-2-4-13(5-3-12)6-7-8-10-11-9-7;1-2(3)4/h2-6H2,1H3,(H,8,9,10,11);1H3,(H,3,4)