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

Systemtic Name: 6-[(4-methoxyphenyl)methyl]-4,7,8-trimethyl-2-prop-2-enyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 2-allyl-6-[(4-methoxyphenyl)methyl]-4,7,8-trimethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 6-[(4-methoxyphenyl)methyl]-4,7,8-trimethyl-2-prop-2-enylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-[(4-methoxyphenyl)methyl]-4,7,8-trimethyl-2-prop-2-enylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 2-allyl-4,7,8-trimethyl-6-p-anisyl-purin[7,8-a]imidazole-1,3-quinone Formula: C21H23N5O3 MolecularWeight: 393.43902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C3=C(N=C2N1CC4=CC=C(C=C4)OC)N(C(=O)N(C3=O)CC=C)C)C

Isomeric SMILES

CC1=C(N2C3=C(N=C2N1CC4=CC=C(C=C4)OC)N(C(=O)N(C3=O)CC=C)C)C

InChI

InChI=1S/C21H23N5O3/c1-6-11-24-19(27)17-18(23(4)21(24)28)22-20-25(13(2)14(3)26(17)20)12-15-7-9-16(29-5)10-8-15/h6-10H,1,11-12H2,2-5H3