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

Systemtic Name: 4,7-dimethyl-2-(naphthalen-1-ylmethyl)-6-(3-oxidanylpropyl)purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-(3-hydroxypropyl)-4,7-dimethyl-2-(1-naphthylmethyl)purino[7,8-a]imidazole-1,3-dione CAS Name: 6-(3-hydroxypropyl)-4,7-dimethyl-2-(1-naphthalenylmethyl)purino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-(3-hydroxypropyl)-4,7-dimethyl-2-(naphthalen-1-ylmethyl)purino[7,8-a]imidazole-1,3-dione Traditional Name: 6-(3-hydroxypropyl)-4,7-dimethyl-2-(1-naphthylmethyl)purin[7,8-a]imidazole-1,3-quinone Formula: C23H23N5O3 MolecularWeight: 417.46042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C3=C(N=C2N1CCCO)N(C(=O)N(C3=O)CC4=CC=CC5=CC=CC=C54)C

Isomeric SMILES

CC1=CN2C3=C(N=C2N1CCCO)N(C(=O)N(C3=O)CC4=CC=CC5=CC=CC=C54)C

InChI

InChI=1S/C23H23N5O3/c1-15-13-27-19-20(24-22(27)26(15)11-6-12-29)25(2)23(31)28(21(19)30)14-17-9-5-8-16-7-3-4-10-18(16)17/h3-5,7-10,13,29H,6,11-12,14H2,1-2H3