2-chloranyl-2-(8-phenylmethoxypurin-9-yl)ethanoic acid

Systemtic Name: 2-chloranyl-2-(8-phenylmethoxypurin-9-yl)ethanoic acid Openeye Name: 2-(8-benzyloxypurin-9-yl)-2-chloro-acetic acid CAS Name: 2-chloro-2-(8-phenylmethoxy-9-purinyl)acetic acid IUPAC Name: 2-chloro-2-(8-phenylmethoxypurin-9-yl)acetic acid Traditional Name: 2-(8-benzoxypurin-9-yl)-2-chloro-acetic acid Formula: C14H11ClN4O3 MolecularWeight: 318.71514

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=NC3=CN=CN=C3N2C(C(=O)O)Cl

Isomeric SMILES

C1=CC=C(C=C1)COC2=NC3=CN=CN=C3N2C(C(=O)O)Cl

InChI

InChI=1S/C14H11ClN4O3/c15-11(13(20)21)19-12-10(6-16-8-17-12)18-14(19)22-7-9-4-2-1-3-5-9/h1-6,8,11H,7H2,(H,20,21)