4-[3-[[2,4-bis(azanyl)pyrimidin-5-yl]methyl]-4-methoxy-phenoxy]butanoic acid

Systemtic Name: 4-[3-[[2,4-bis(azanyl)pyrimidin-5-yl]methyl]-4-methoxy-phenoxy]butanoic acid Openeye Name: 4-[3-[(2,4-diaminopyrimidin-5-yl)methyl]-4-methoxy-phenoxy]butanoic acid CAS Name: 4-[3-[(2,4-diamino-5-pyrimidinyl)methyl]-4-methoxyphenoxy]butanoic acid IUPAC Name: 4-[3-[(2,4-diaminopyrimidin-5-yl)methyl]-4-methoxyphenoxy]butanoic acid Traditional Name: 4-[3-[(2,4-diaminopyrimidin-5-yl)methyl]-4-methoxy-phenoxy]butyric acid Formula: C16H20N4O4 MolecularWeight: 332.3544

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)OCCCC(=O)O)CC2=CN=C(N=C2N)N

Isomeric SMILES

COC1=C(C=C(C=C1)OCCCC(=O)O)CC2=CN=C(N=C2N)N

InChI

InChI=1S/C16H20N4O4/c1-23-13-5-4-12(24-6-2-3-14(21)22)8-10(13)7-11-9-19-16(18)20-15(11)17/h4-5,8-9H,2-3,6-7H2,1H3,(H,21,22)(H4,17,18,19,20)