2-[[1,3-dimethyl-7-(naphthalen-1-ylmethyl)-2,6-bis(oxidanylidene)purin-8-yl]amino]ethylazanium

Systemtic Name: 2-[[1,3-dimethyl-7-(naphthalen-1-ylmethyl)-2,6-bis(oxidanylidene)purin-8-yl]amino]ethylazanium Openeye Name: 2-[[1,3-dimethyl-7-(1-naphthylmethyl)-2,6-dioxo-purin-8-yl]amino]ethylammonium CAS Name: 2-[[1,3-dimethyl-7-(1-naphthalenylmethyl)-2,6-dioxo-8-purinyl]amino]ethylammonium IUPAC Name: 2-[[1,3-dimethyl-7-(naphthalen-1-ylmethyl)-2,6-dioxopurin-8-yl]amino]ethylazanium Traditional Name: 2-[[2,6-diketo-1,3-dimethyl-7-(1-naphthylmethyl)purin-8-yl]amino]ethylammonium Formula: C20H23N6O2+ MolecularWeight: 379.43562

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NCC[NH3+])CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NCC[NH3+])CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C20H22N6O2/c1-24-17-16(18(27)25(2)20(24)28)26(19(23-17)22-11-10-21)12-14-8-5-7-13-6-3-4-9-15(13)14/h3-9H,10-12,21H2,1-2H3,(H,22,23)/p+1