2-[[9-(4-methoxyphenyl)purin-6-yl]amino]ethanoic acid

Systemtic Name: 2-[[9-(4-methoxyphenyl)purin-6-yl]amino]ethanoic acid Openeye Name: 2-[[9-(4-methoxyphenyl)purin-6-yl]amino]acetic acid CAS Name: 2-[[9-(4-methoxyphenyl)-6-purinyl]amino]acetic acid IUPAC Name: 2-[[9-(4-methoxyphenyl)purin-6-yl]amino]acetic acid Traditional Name: 2-[[9-(4-methoxyphenyl)purin-6-yl]amino]acetic acid Formula: C14H13N5O3 MolecularWeight: 299.28472

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C=NC3=C2N=CN=C3NCC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)N2C=NC3=C2N=CN=C3NCC(=O)O

InChI

InChI=1S/C14H13N5O3/c1-22-10-4-2-9(3-5-10)19-8-18-12-13(15-6-11(20)21)16-7-17-14(12)19/h2-5,7-8H,6H2,1H3,(H,20,21)(H,15,16,17)