4-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]butylboronic acid

Systemtic Name: 4-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]butylboronic acid Openeye Name: 4-(5-methyl-2,4-dioxo-pyrimidin-1-yl)butylboronic acid CAS Name: 4-(5-methyl-2,4-dioxo-1-pyrimidinyl)butylboronic acid IUPAC Name: 4-(5-methyl-2,4-dioxopyrimidin-1-yl)butylboronic acid Traditional Name: 4-(2,4-diketo-5-methyl-pyrimidin-1-yl)butylboronic acid Formula: C9H15BN2O4 MolecularWeight: 226.0374

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Descriptors Computed from Structure

Canonical SMILES:

B(CCCCN1C=C(C(=O)NC1=O)C)(O)O

Isomeric SMILES

B(CCCCN1C=C(C(=O)NC1=O)C)(O)O

InChI

InChI=1S/C9H15BN2O4/c1-7-6-12(9(14)11-8(7)13)5-3-2-4-10(15)16/h6,15-16H,2-5H2,1H3,(H,11,13,14)