1-(benzotriazol-1-ylmethyl)-N-[(E)-2-phenylprop-1-enyl]pyridin-1-ium-2-amine

Systemtic Name: 1-(benzotriazol-1-ylmethyl)-N-[(E)-2-phenylprop-1-enyl]pyridin-1-ium-2-amine Openeye Name: 1-(benzotriazol-1-ylmethyl)-N-[(E)-2-phenylprop-1-enyl]pyridin-1-ium-2-amine CAS Name: 1-(1-benzotriazolylmethyl)-N-[(E)-2-phenylprop-1-enyl]-2-pyridin-1-iumamine IUPAC Name: 1-(benzotriazol-1-ylmethyl)-N-[(E)-2-phenylprop-1-enyl]pyridin-1-ium-2-amine Traditional Name: [1-(benzotriazol-1-ylmethyl)pyridin-1-ium-2-yl]-[(E)-2-phenylprop-1-enyl]amine Formula: C21H20N5+ MolecularWeight: 342.417

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CNC1=CC=CC=[N+]1CN2C3=CC=CC=C3N=N2)C4=CC=CC=C4

Isomeric SMILES

C/C(=C\NC1=CC=CC=[N+]1CN2C3=CC=CC=C3N=N2)/C4=CC=CC=C4

InChI

InChI=1S/C21H19N5/c1-17(18-9-3-2-4-10-18)15-22-21-13-7-8-14-25(21)16-26-20-12-6-5-11-19(20)23-24-26/h2-15H,16H2,1H3/p+1/b17-15+