2-[4-[[2,4-bis(azanyl)pyrimidin-5-yl]methyl]-2-iodanyl-6-methoxy-phenoxy]ethanoic acid

Systemtic Name: 2-[4-[[2,4-bis(azanyl)pyrimidin-5-yl]methyl]-2-iodanyl-6-methoxy-phenoxy]ethanoic acid Openeye Name: 2-[4-[(2,4-diaminopyrimidin-5-yl)methyl]-2-iodo-6-methoxy-phenoxy]acetic acid CAS Name: 2-[4-[(2,4-diamino-5-pyrimidinyl)methyl]-2-iodo-6-methoxyphenoxy]acetic acid IUPAC Name: 2-[4-[(2,4-diaminopyrimidin-5-yl)methyl]-2-iodo-6-methoxyphenoxy]acetic acid Traditional Name: 2-[4-[(2,4-diaminopyrimidin-5-yl)methyl]-2-iodo-6-methoxy-phenoxy]acetic acid Formula: C14H15IN4O4 MolecularWeight: 430.19777

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CC2=CN=C(N=C2N)N)I)OCC(=O)O

Isomeric SMILES

COC1=C(C(=CC(=C1)CC2=CN=C(N=C2N)N)I)OCC(=O)O

InChI

InChI=1S/C14H15IN4O4/c1-22-10-4-7(2-8-5-18-14(17)19-13(8)16)3-9(15)12(10)23-6-11(20)21/h3-5H,2,6H2,1H3,(H,20,21)(H4,16,17,18,19)