4-(benzotriazol-1-ylmethyl)-4-methyl-morpholin-4-ium iodide

Systemtic Name: 4-(benzotriazol-1-ylmethyl)-4-methyl-morpholin-4-ium iodide Openeye Name: 4-(benzotriazol-1-ylmethyl)-4-methyl-morpholin-4-ium iodide CAS Name: 4-(1-benzotriazolylmethyl)-4-methylmorpholin-4-ium iodide IUPAC Name: 4-(benzotriazol-1-ylmethyl)-4-methylmorpholin-4-ium iodide Traditional Name: 4-(benzotriazol-1-ylmethyl)-4-methyl-morpholin-4-ium iodide Formula: C12H17IN4O MolecularWeight: 360.19405

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCOCC1)CN2C3=CC=CC=C3N=N2.[I-]

Isomeric SMILES

C[N+]1(CCOCC1)CN2C3=CC=CC=C3N=N2.[I-]

InChI

InChI=1S/C12H17N4O.HI/c1-16(6-8-17-9-7-16)10-15-12-5-3-2-4-11(12)13-14-15;/h2-5H,6-10H2,1H3;1H/q+1;/p-1