1-[(4-methylpiperazine-1,4-diium-1-yl)methyl]benzotriazole

Systemtic Name: 1-[(4-methylpiperazine-1,4-diium-1-yl)methyl]benzotriazole Openeye Name: 1-[(4-methylpiperazine-1,4-diium-1-yl)methyl]benzotriazole CAS Name: 1-[(4-methyl-1-piperazine-1,4-diiumyl)methyl]benzotriazole IUPAC Name: 1-[(4-methylpiperazine-1,4-diium-1-yl)methyl]benzotriazole Traditional Name: 1-[(4-methylpiperazine-1,4-diium-1-yl)methyl]benzotriazole Formula: C12H19N5+2 MolecularWeight: 233.31276

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CN2C3=CC=CC=C3N=N2

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C12H17N5/c1-15-6-8-16(9-7-15)10-17-12-5-3-2-4-11(12)13-14-17/h2-5H,6-10H2,1H3/p+2