6-(1,3-benzodioxol-5-ylmethyl)-2,4-dimethyl-7-naphthalen-2-yl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 6-(1,3-benzodioxol-5-ylmethyl)-2,4-dimethyl-7-naphthalen-2-yl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-(1,3-benzodioxol-5-ylmethyl)-2,4-dimethyl-7-(2-naphthyl)purino[7,8-a]imidazole-1,3-dione CAS Name: 6-(1,3-benzodioxol-5-ylmethyl)-2,4-dimethyl-7-(2-naphthalenyl)purino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-(1,3-benzodioxol-5-ylmethyl)-2,4-dimethyl-7-naphthalen-2-ylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 2,4-dimethyl-7-(2-naphthyl)-6-piperonyl-purin[7,8-a]imidazole-1,3-quinone Formula: C27H21N5O4 MolecularWeight: 479.48674

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N3C=C(N(C3=N2)CC4=CC5=C(C=C4)OCO5)C6=CC7=CC=CC=C7C=C6

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N3C=C(N(C3=N2)CC4=CC5=C(C=C4)OCO5)C6=CC7=CC=CC=C7C=C6

InChI

InChI=1S/C27H21N5O4/c1-29-24-23(25(33)30(2)27(29)34)32-14-20(19-9-8-17-5-3-4-6-18(17)12-19)31(26(32)28-24)13-16-7-10-21-22(11-16)36-15-35-21/h3-12,14H,13,15H2,1-2H3