2-chloranyl-9-phenethyl-3H-purin-6-one

Systemtic Name: 2-chloranyl-9-phenethyl-3H-purin-6-one Openeye Name: 2-chloro-9-phenethyl-3H-purin-6-one CAS Name: 2-chloro-9-phenethyl-3H-purin-6-one IUPAC Name: 2-chloro-9-phenethyl-3H-purin-6-one Traditional Name: 2-chloro-9-phenethyl-3H-purin-6-one Formula: C13H11ClN4O MolecularWeight: 274.70564

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C=NC3=C2NC(=NC3=O)Cl

Isomeric SMILES

C1=CC=C(C=C1)CCN2C=NC3=C2NC(=NC3=O)Cl

InChI

InChI=1S/C13H11ClN4O/c14-13-16-11-10(12(19)17-13)15-8-18(11)7-6-9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H,16,17,19)