6-[(4-methoxyphenyl)methyl]-4,7,8-trimethyl-2-pentyl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 6-[(4-methoxyphenyl)methyl]-4,7,8-trimethyl-2-pentyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-[(4-methoxyphenyl)methyl]-4,7,8-trimethyl-2-pentyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 6-[(4-methoxyphenyl)methyl]-4,7,8-trimethyl-2-pentylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-[(4-methoxyphenyl)methyl]-4,7,8-trimethyl-2-pentylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 2-amyl-4,7,8-trimethyl-6-p-anisyl-purin[7,8-a]imidazole-1,3-quinone Formula: C23H29N5O3 MolecularWeight: 423.50806

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=C(N=C3N2C(=C(N3CC4=CC=C(C=C4)OC)C)C)N(C1=O)C

Isomeric SMILES

CCCCCN1C(=O)C2=C(N=C3N2C(=C(N3CC4=CC=C(C=C4)OC)C)C)N(C1=O)C

InChI

InChI=1S/C23H29N5O3/c1-6-7-8-13-26-21(29)19-20(25(4)23(26)30)24-22-27(15(2)16(3)28(19)22)14-17-9-11-18(31-5)12-10-17/h9-12H,6-8,13-14H2,1-5H3