6-(1H-imidazol-3-ium-2-ylmethyl)-3-[(2-methylphenyl)methyl]-1-(pyridin-2-ylmethyl)-7,8-dihydro-5H-1,6-naphthyridin-2-one

Systemtic Name: 6-(1H-imidazol-3-ium-2-ylmethyl)-3-[(2-methylphenyl)methyl]-1-(pyridin-2-ylmethyl)-7,8-dihydro-5H-1,6-naphthyridin-2-one Openeye Name: 6-(1H-imidazol-3-ium-2-ylmethyl)-3-(o-tolylmethyl)-1-(2-pyridylmethyl)-7,8-dihydro-5H-1,6-naphthyridin-2-one CAS Name: 6-(1H-imidazol-3-ium-2-ylmethyl)-3-[(2-methylphenyl)methyl]-1-(2-pyridinylmethyl)-7,8-dihydro-5H-1,6-naphthyridin-2-one IUPAC Name: 6-(1H-imidazol-3-ium-2-ylmethyl)-3-[(2-methylphenyl)methyl]-1-(pyridin-2-ylmethyl)-7,8-dihydro-5H-1,6-naphthyridin-2-one Traditional Name: 6-(1H-imidazol-3-ium-2-ylmethyl)-3-(2-methylbenzyl)-1-(2-pyridylmethyl)-7,8-dihydro-5H-1,6-naphthyridin-2-one Formula: C26H28N5O+ MolecularWeight: 426.53342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC2=CC3=C(CCN(C3)CC4=[NH+]C=CN4)N(C2=O)CC5=CC=CC=N5

Isomeric SMILES

CC1=CC=CC=C1CC2=CC3=C(CCN(C3)CC4=[NH+]C=CN4)N(C2=O)CC5=CC=CC=N5

InChI

InChI=1S/C26H27N5O/c1-19-6-2-3-7-20(19)14-21-15-22-16-30(18-25-28-11-12-29-25)13-9-24(22)31(26(21)32)17-23-8-4-5-10-27-23/h2-8,10-12,15H,9,13-14,16-18H2,1H3,(H,28,29)/p+1