9-ethyl-3-[methyl(2-pyridin-1-ium-1-ylethyl)amino]-4,5-dihydroimidazo[5,1-h]pteridin-6-one

Systemtic Name: 9-ethyl-3-[methyl(2-pyridin-1-ium-1-ylethyl)amino]-4,5-dihydroimidazo[5,1-h]pteridin-6-one Openeye Name: 9-ethyl-3-[methyl(2-pyridin-1-ium-1-ylethyl)amino]-4,5-dihydroimidazo[5,1-h]pteridin-6-one CAS Name: 9-ethyl-3-[methyl-[2-(1-pyridin-1-iumyl)ethyl]amino]-4,5-dihydroimidazo[5,1-h]pteridin-6-one IUPAC Name: 9-ethyl-3-[methyl(2-pyridin-1-ium-1-ylethyl)amino]-4,5-dihydroimidazo[5,1-h]pteridin-6-one Traditional Name: 9-ethyl-3-[methyl(2-pyridin-1-ium-1-ylethyl)amino]-4,5-dihydroimidazo[5,1-h]pteridin-6-one Formula: C18H22N7O+ MolecularWeight: 352.41358

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC=C2N1C3=C(CN(C=N3)N(C)CC[N+]4=CC=CC=C4)NC2=O

Isomeric SMILES

CCC1=NC=C2N1C3=C(CN(C=N3)N(C)CC[N+]4=CC=CC=C4)NC2=O

InChI

InChI=1S/C18H21N7O/c1-3-16-19-11-15-18(26)21-14-12-24(13-20-17(14)25(15)16)22(2)9-10-23-7-5-4-6-8-23/h4-8,11,13H,3,9-10,12H2,1-2H3/p+1