2-(2-hydroxyethyl)-7-methyl-4-(phenylmethyl)-6H-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 2-(2-hydroxyethyl)-7-methyl-4-(phenylmethyl)-6H-purino[7,8-a]imidazole-1,3-dione Openeye Name: 4-benzyl-2-(2-hydroxyethyl)-7-methyl-6H-purino[7,8-a]imidazole-1,3-dione CAS Name: 2-(2-hydroxyethyl)-7-methyl-4-(phenylmethyl)-6H-purino[7,8-a]imidazole-1,3-dione IUPAC Name: 4-benzyl-2-(2-hydroxyethyl)-7-methyl-6H-purino[7,8-a]imidazole-1,3-dione Traditional Name: 4-benzyl-2-(2-hydroxyethyl)-7-methyl-6H-purin[7,8-a]imidazole-1,3-quinone Formula: C17H17N5O3 MolecularWeight: 339.34858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C3=C(N=C2N1)N(C(=O)N(C3=O)CCO)CC4=CC=CC=C4

Isomeric SMILES

CC1=CN2C3=C(N=C2N1)N(C(=O)N(C3=O)CCO)CC4=CC=CC=C4

InChI

InChI=1S/C17H17N5O3/c1-11-9-21-13-14(19-16(21)18-11)22(10-12-5-3-2-4-6-12)17(25)20(7-8-23)15(13)24/h2-6,9,23H,7-8,10H2,1H3,(H,18,19)