N'-methyl-N'-phenyl-N-pyridin-1-ium-4-yl-propane-1,3-diamine

Systemtic Name: N'-methyl-N'-phenyl-N-pyridin-1-ium-4-yl-propane-1,3-diamine Openeye Name: N'-methyl-N'-phenyl-N-pyridin-1-ium-4-yl-propane-1,3-diamine CAS Name: N'-methyl-N'-phenyl-N-(4-pyridin-1-iumyl)propane-1,3-diamine IUPAC Name: N'-methyl-N'-phenyl-N-pyridin-1-ium-4-ylpropane-1,3-diamine Traditional Name: methyl-phenyl-[3-(pyridin-1-ium-4-ylamino)propyl]amine Formula: C15H20N3+ MolecularWeight: 242.3394

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC1=CC=[NH+]C=C1)C2=CC=CC=C2

Isomeric SMILES

CN(CCCNC1=CC=[NH+]C=C1)C2=CC=CC=C2

InChI

InChI=1S/C15H19N3/c1-18(15-6-3-2-4-7-15)13-5-10-17-14-8-11-16-12-9-14/h2-4,6-9,11-12H,5,10,13H2,1H3,(H,16,17)/p+1