4-(3-nitrophenyl)-5-piperidin-4-yl-1,2-oxazol-3-one hydrobromide

Systemtic Name: 4-(3-nitrophenyl)-5-piperidin-4-yl-1,2-oxazol-3-one hydrobromide Openeye Name: 4-(3-nitrophenyl)-5-(4-piperidyl)isoxazol-3-one hydrobromide CAS Name: 4-(3-nitrophenyl)-5-(4-piperidinyl)-3-isoxazolone hydrobromide IUPAC Name: 4-(3-nitrophenyl)-5-piperidin-4-yl-1,2-oxazol-3-one hydrobromide Traditional Name: 4-(3-nitrophenyl)-5-(4-piperidyl)-4-isoxazolin-3-one hydrobromide Formula: C14H16BrN3O4 MolecularWeight: 370.19854

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2=C(C(=O)NO2)C3=CC(=CC=C3)[N+](=O)[O-].Br

Isomeric SMILES

C1CNCCC1C2=C(C(=O)NO2)C3=CC(=CC=C3)[N+](=O)[O-].Br

InChI

InChI=1S/C14H15N3O4.BrH/c18-14-12(10-2-1-3-11(8-10)17(19)20)13(21-16-14)9-4-6-15-7-5-9;/h1-3,8-9,15H,4-7H2,(H,16,18);1H