N-(1,3-benzodioxol-5-yl)-4-nitro-5-propan-2-yl-1,2-oxazole-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-4-nitro-5-propan-2-yl-1,2-oxazole-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-5-isopropyl-4-nitro-isoxazole-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-4-nitro-5-propan-2-yl-3-isoxazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-4-nitro-5-propan-2-yl-1,2-oxazole-3-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-5-isopropyl-4-nitro-isoxazole-3-carboxamide Formula: C14H13N3O6 MolecularWeight: 319.26952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=NO1)C(=O)NC2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=C(C(=NO1)C(=O)NC2=CC3=C(C=C2)OCO3)[N+](=O)[O-]

InChI

InChI=1S/C14H13N3O6/c1-7(2)13-12(17(19)20)11(16-23-13)14(18)15-8-3-4-9-10(5-8)22-6-21-9/h3-5,7H,6H2,1-2H3,(H,15,18)