1-pyridin-1-ium-2-yl-N,N-bis(pyridin-1-ium-2-ylmethyl)methanamine

Systemtic Name: 1-pyridin-1-ium-2-yl-N,N-bis(pyridin-1-ium-2-ylmethyl)methanamine Openeye Name: 1-pyridin-1-ium-2-yl-N,N-bis(pyridin-1-ium-2-ylmethyl)methanamine CAS Name: 1-(2-pyridin-1-iumyl)-N,N-bis(2-pyridin-1-iumylmethyl)methanamine IUPAC Name: 1-pyridin-1-ium-2-yl-N,N-bis(pyridin-1-ium-2-ylmethyl)methanamine Traditional Name: tris(pyridin-1-ium-2-ylmethyl)amine Formula: C18H21N4+3 MolecularWeight: 293.38614

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[NH+]C(=C1)CN(CC2=CC=CC=[NH+]2)CC3=CC=CC=[NH+]3

Isomeric SMILES

C1=CC=[NH+]C(=C1)CN(CC2=CC=CC=[NH+]2)CC3=CC=CC=[NH+]3

InChI

InChI=1S/C18H18N4/c1-4-10-19-16(7-1)13-22(14-17-8-2-5-11-20-17)15-18-9-3-6-12-21-18/h1-12H,13-15H2/p+3