4-[[2,4-bis(azanyl)pyrimidin-5-yl]methyl]-2,6-diethoxy-benzoic acid

Systemtic Name: 4-[[2,4-bis(azanyl)pyrimidin-5-yl]methyl]-2,6-diethoxy-benzoic acid Openeye Name: 4-[(2,4-diaminopyrimidin-5-yl)methyl]-2,6-diethoxy-benzoic acid CAS Name: 4-[(2,4-diamino-5-pyrimidinyl)methyl]-2,6-diethoxybenzoic acid IUPAC Name: 4-[(2,4-diaminopyrimidin-5-yl)methyl]-2,6-diethoxybenzoic acid Traditional Name: 4-[(2,4-diaminopyrimidin-5-yl)methyl]-2,6-diethoxy-benzoic acid Formula: C16H20N4O4 MolecularWeight: 332.3544

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1C(=O)O)OCC)CC2=CN=C(N=C2N)N

Isomeric SMILES

CCOC1=CC(=CC(=C1C(=O)O)OCC)CC2=CN=C(N=C2N)N

InChI

InChI=1S/C16H20N4O4/c1-3-23-11-6-9(5-10-8-19-16(18)20-14(10)17)7-12(24-4-2)13(11)15(21)22/h6-8H,3-5H2,1-2H3,(H,21,22)(H4,17,18,19,20)