5-(benzotriazol-1-ylmethyl)pyridin-1-ium-2-amine

Systemtic Name: 5-(benzotriazol-1-ylmethyl)pyridin-1-ium-2-amine Openeye Name: 5-(benzotriazol-1-ylmethyl)pyridin-1-ium-2-amine CAS Name: 5-(1-benzotriazolylmethyl)-2-pyridin-1-iumamine IUPAC Name: 5-(benzotriazol-1-ylmethyl)pyridin-1-ium-2-amine Traditional Name: [5-(benzotriazol-1-ylmethyl)pyridin-1-ium-2-yl]amine Formula: C12H12N5+ MolecularWeight: 226.25718

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2CC3=C[NH+]=C(C=C3)N

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2CC3=C[NH+]=C(C=C3)N

InChI

InChI=1S/C12H11N5/c13-12-6-5-9(7-14-12)8-17-11-4-2-1-3-10(11)15-16-17/h1-7H,8H2,(H2,13,14)/p+1