7-chloranyl-6-(3,4-dimethoxyphenyl)-3-(2-hydroxyethyl)-1-methyl-pteridine-2,4-dione

Systemtic Name: 7-chloranyl-6-(3,4-dimethoxyphenyl)-3-(2-hydroxyethyl)-1-methyl-pteridine-2,4-dione Openeye Name: 7-chloro-6-(3,4-dimethoxyphenyl)-3-(2-hydroxyethyl)-1-methyl-pteridine-2,4-dione CAS Name: 7-chloro-6-(3,4-dimethoxyphenyl)-3-(2-hydroxyethyl)-1-methylpteridine-2,4-dione IUPAC Name: 7-chloro-6-(3,4-dimethoxyphenyl)-3-(2-hydroxyethyl)-1-methylpteridine-2,4-dione Traditional Name: 7-chloro-6-(3,4-dimethoxyphenyl)-3-(2-hydroxyethyl)-1-methyl-pteridine-2,4-quinone Formula: C17H17ClN4O5 MolecularWeight: 392.79368

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)CCO)N=C(C(=N2)Cl)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)CCO)N=C(C(=N2)Cl)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C17H17ClN4O5/c1-21-15-13(16(24)22(6-7-23)17(21)25)19-12(14(18)20-15)9-4-5-10(26-2)11(8-9)27-3/h4-5,8,23H,6-7H2,1-3H3