4-(bromomethyl)-5-heptan-4-yl-2-(methoxymethyl)-1,2-oxazol-3-one

Systemtic Name: 4-(bromomethyl)-5-heptan-4-yl-2-(methoxymethyl)-1,2-oxazol-3-one Openeye Name: 4-(bromomethyl)-2-(methoxymethyl)-5-(1-propylbutyl)isoxazol-3-one CAS Name: 4-(bromomethyl)-5-heptan-4-yl-2-(methoxymethyl)-3-isoxazolone IUPAC Name: 4-(bromomethyl)-5-heptan-4-yl-2-(methoxymethyl)-1,2-oxazol-3-one Traditional Name: 4-(bromomethyl)-2-(methoxymethyl)-5-(1-propylbutyl)-4-isoxazolin-3-one Formula: C13H22BrNO3 MolecularWeight: 320.22268

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C1=C(C(=O)N(O1)COC)CBr

Isomeric SMILES

CCCC(CCC)C1=C(C(=O)N(O1)COC)CBr

InChI

InChI=1S/C13H22BrNO3/c1-4-6-10(7-5-2)12-11(8-14)13(16)15(18-12)9-17-3/h10H,4-9H2,1-3H3