2-[[3,5-bis(chloranyl)phenyl]amino]-9-(2-hydroxyethyloxymethyl)-3H-purin-6-one

Systemtic Name: 2-[[3,5-bis(chloranyl)phenyl]amino]-9-(2-hydroxyethyloxymethyl)-3H-purin-6-one Openeye Name: 2-(3,5-dichloroanilino)-9-(2-hydroxyethoxymethyl)-3H-purin-6-one CAS Name: 2-(3,5-dichloroanilino)-9-(2-hydroxyethoxymethyl)-3H-purin-6-one IUPAC Name: 2-(3,5-dichloroanilino)-9-(2-hydroxyethoxymethyl)-3H-purin-6-one Traditional Name: 2-(3,5-dichloroanilino)-9-(2-hydroxyethoxymethyl)-3H-purin-6-one Formula: C14H13Cl2N5O3 MolecularWeight: 370.19072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1Cl)Cl)NC2=NC(=O)C3=C(N2)N(C=N3)COCCO

Isomeric SMILES

C1=C(C=C(C=C1Cl)Cl)NC2=NC(=O)C3=C(N2)N(C=N3)COCCO

InChI

InChI=1S/C14H13Cl2N5O3/c15-8-3-9(16)5-10(4-8)18-14-19-12-11(13(23)20-14)17-6-21(12)7-24-2-1-22/h3-6,22H,1-2,7H2,(H2,18,19,20,23)