5-[2-[(4-chlorophenyl)-phenyl-methoxy]ethyl]-3,7-dimethyl-8,9-dihydro-4H-purine-2,6-dione

Systemtic Name: 5-[2-[(4-chlorophenyl)-phenyl-methoxy]ethyl]-3,7-dimethyl-8,9-dihydro-4H-purine-2,6-dione Openeye Name: 5-[2-[(4-chlorophenyl)-phenyl-methoxy]ethyl]-3,7-dimethyl-8,9-dihydro-4H-purine-2,6-dione CAS Name: 5-[2-[(4-chlorophenyl)-phenylmethoxy]ethyl]-3,7-dimethyl-8,9-dihydro-4H-purine-2,6-dione IUPAC Name: 5-[2-[(4-chlorophenyl)-phenylmethoxy]ethyl]-3,7-dimethyl-8,9-dihydro-4H-purine-2,6-dione Traditional Name: 5-[2-[(4-chlorophenyl)-phenyl-methoxy]ethyl]-3,7-dimethyl-8,9-dihydro-4H-purine-2,6-quinone Formula: C22H25ClN4O3 MolecularWeight: 428.9119

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Descriptors Computed from Structure

Canonical SMILES:

CN1CNC2C1(C(=O)NC(=O)N2C)CCOC(C3=CC=CC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CN1CNC2C1(C(=O)NC(=O)N2C)CCOC(C3=CC=CC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H25ClN4O3/c1-26-14-24-19-22(26,20(28)25-21(29)27(19)2)12-13-30-18(15-6-4-3-5-7-15)16-8-10-17(23)11-9-16/h3-11,18-19,24H,12-14H2,1-2H3,(H,25,28,29)