2-azanyl-3-[9-(phenylmethyl)purin-6-yl]propanoic acid

Systemtic Name: 2-azanyl-3-[9-(phenylmethyl)purin-6-yl]propanoic acid Openeye Name: 2-amino-3-(9-benzylpurin-6-yl)propanoic acid CAS Name: 2-amino-3-[9-(phenylmethyl)-6-purinyl]propanoic acid IUPAC Name: 2-amino-3-(9-benzylpurin-6-yl)propanoic acid Traditional Name: 2-amino-3-(9-benzylpurin-6-yl)propionic acid Formula: C15H15N5O2 MolecularWeight: 297.3119

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC3=C(N=CN=C32)CC(C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)CN2C=NC3=C(N=CN=C32)CC(C(=O)O)N

InChI

InChI=1S/C15H15N5O2/c16-11(15(21)22)6-12-13-14(18-8-17-12)20(9-19-13)7-10-4-2-1-3-5-10/h1-5,8-9,11H,6-7,16H2,(H,21,22)