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

Systemtic Name: 4-(naphthalen-1-ylmethyl)-5-piperidin-1-ium-4-yl-1,2-oxazol-3-one bromide Openeye Name: 4-(1-naphthylmethyl)-5-piperidin-1-ium-4-yl-isoxazol-3-one bromide CAS Name: 4-(1-naphthalenylmethyl)-5-(4-piperidin-1-iumyl)-3-isoxazolone bromide IUPAC Name: 4-(naphthalen-1-ylmethyl)-5-piperidin-1-ium-4-yl-1,2-oxazol-3-one bromide Traditional Name: 4-(1-naphthylmethyl)-5-piperidin-1-ium-4-yl-4-isoxazolin-3-one bromide Formula: C19H21BrN2O2 MolecularWeight: 389.28624

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCC1C2=C(C(=O)NO2)CC3=CC=CC4=CC=CC=C43.[Br-]

Isomeric SMILES

C1C[NH2+]CCC1C2=C(C(=O)NO2)CC3=CC=CC4=CC=CC=C43.[Br-]

InChI

InChI=1S/C19H20N2O2.BrH/c22-19-17(18(23-21-19)14-8-10-20-11-9-14)12-15-6-3-5-13-4-1-2-7-16(13)15;/h1-7,14,20H,8-12H2,(H,21,22);1H