2-[4-(4-azanylbutyl)-1,2,3-triazol-1-yl]-1-piperazin-1-yl-ethanone

Systemtic Name: 2-[4-(4-azanylbutyl)-1,2,3-triazol-1-yl]-1-piperazin-1-yl-ethanone Openeye Name: 2-[4-(4-aminobutyl)triazol-1-yl]-1-piperazin-1-yl-ethanone CAS Name: 2-[4-(4-aminobutyl)-1-triazolyl]-1-(1-piperazinyl)ethanone IUPAC Name: 2-[4-(4-aminobutyl)triazol-1-yl]-1-piperazin-1-ylethanone Traditional Name: 2-[4-(4-aminobutyl)triazol-1-yl]-1-piperazino-ethanone Formula: C12H22N6O MolecularWeight: 266.34268

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(=O)CN2C=C(N=N2)CCCCN

Isomeric SMILES

C1CN(CCN1)C(=O)CN2C=C(N=N2)CCCCN

InChI

InChI=1S/C12H22N6O/c13-4-2-1-3-11-9-18(16-15-11)10-12(19)17-7-5-14-6-8-17/h9,14H,1-8,10,13H2