8-[[4-(4-chlorophenyl)carbonylphenyl]methyl]-3-methyl-7H-purine-2,6-dione

Systemtic Name: 8-[[4-(4-chlorophenyl)carbonylphenyl]methyl]-3-methyl-7H-purine-2,6-dione Openeye Name: 8-[[4-(4-chlorobenzoyl)phenyl]methyl]-3-methyl-7H-purine-2,6-dione CAS Name: 8-[[4-[(4-chlorophenyl)-oxomethyl]phenyl]methyl]-3-methyl-7H-purine-2,6-dione IUPAC Name: 8-[[4-(4-chlorobenzoyl)phenyl]methyl]-3-methyl-7H-purine-2,6-dione Traditional Name: 8-[4-(4-chlorobenzoyl)benzyl]-3-methyl-7H-purine-2,6-quinone Formula: C20H15ClN4O3 MolecularWeight: 394.8111

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)NC(=N2)CC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)NC(=N2)CC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H15ClN4O3/c1-25-18-16(19(27)24-20(25)28)22-15(23-18)10-11-2-4-12(5-3-11)17(26)13-6-8-14(21)9-7-13/h2-9H,10H2,1H3,(H,22,23)(H,24,27,28)