[2-[cyclohexyl(methyl)amino]pyridin-1-ium-3-yl]methyl-(pyridin-3-ylmethyl)azanium

Systemtic Name: [2-[cyclohexyl(methyl)amino]pyridin-1-ium-3-yl]methyl-(pyridin-3-ylmethyl)azanium Openeye Name: [2-[cyclohexyl(methyl)amino]pyridin-1-ium-3-yl]methyl-(3-pyridylmethyl)ammonium CAS Name: [2-[cyclohexyl(methyl)amino]-3-pyridin-1-iumyl]methyl-(3-pyridinylmethyl)ammonium IUPAC Name: [2-[cyclohexyl(methyl)amino]pyridin-1-ium-3-yl]methyl-(pyridin-3-ylmethyl)azanium Traditional Name: [2-[cyclohexyl(methyl)amino]pyridin-1-ium-3-yl]methyl-(3-pyridylmethyl)ammonium Formula: C19H28N4+2 MolecularWeight: 312.45242

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C2=C(C=CC=[NH+]2)C[NH2+]CC3=CN=CC=C3

Isomeric SMILES

CN(C1CCCCC1)C2=C(C=CC=[NH+]2)C[NH2+]CC3=CN=CC=C3

InChI

InChI=1S/C19H26N4/c1-23(18-9-3-2-4-10-18)19-17(8-6-12-22-19)15-21-14-16-7-5-11-20-13-16/h5-8,11-13,18,21H,2-4,9-10,14-15H2,1H3/p+2