4-(cyclohexylmethyl)-5-piperidin-1-ium-4-yl-1,2-oxazol-3-one bromide

Systemtic Name: 4-(cyclohexylmethyl)-5-piperidin-1-ium-4-yl-1,2-oxazol-3-one bromide Openeye Name: 4-(cyclohexylmethyl)-5-piperidin-1-ium-4-yl-isoxazol-3-one bromide CAS Name: 4-(cyclohexylmethyl)-5-(4-piperidin-1-iumyl)-3-isoxazolone bromide IUPAC Name: 4-(cyclohexylmethyl)-5-piperidin-1-ium-4-yl-1,2-oxazol-3-one bromide Traditional Name: 4-(cyclohexylmethyl)-5-piperidin-1-ium-4-yl-4-isoxazolin-3-one bromide Formula: C15H25BrN2O2 MolecularWeight: 345.2752

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC2=C(ONC2=O)C3CC[NH2+]CC3.[Br-]

Isomeric SMILES

C1CCC(CC1)CC2=C(ONC2=O)C3CC[NH2+]CC3.[Br-]

InChI

InChI=1S/C15H24N2O2.BrH/c18-15-13(10-11-4-2-1-3-5-11)14(19-17-15)12-6-8-16-9-7-12;/h11-12,16H,1-10H2,(H,17,18);1H