2-(6-azanyl-9-phenylmethoxycarbonyl-purin-2-yl)ethanoic acid

Systemtic Name: 2-(6-azanyl-9-phenylmethoxycarbonyl-purin-2-yl)ethanoic acid Openeye Name: 2-(6-amino-9-benzyloxycarbonyl-purin-2-yl)acetic acid CAS Name: 2-(6-amino-9-phenylmethoxycarbonyl-2-purinyl)acetic acid IUPAC Name: 2-(6-amino-9-phenylmethoxycarbonylpurin-2-yl)acetic acid Traditional Name: 2-(6-amino-9-carbobenzoxy-purin-2-yl)acetic acid Formula: C15H13N5O4 MolecularWeight: 327.29482

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)N2C=NC3=C2N=C(N=C3N)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)N2C=NC3=C2N=C(N=C3N)CC(=O)O

InChI

InChI=1S/C15H13N5O4/c16-13-12-14(19-10(18-13)6-11(21)22)20(8-17-12)15(23)24-7-9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H,21,22)(H2,16,18,19)