N-(1,3-benzodioxol-5-yl)-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-(3,5-dimethyl-4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-(3,5-dimethyl-4-nitropyrazol-1-yl)propanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propionamide Formula: C15H16N4O5 MolecularWeight: 332.31134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(C)C(=O)NC2=CC3=C(C=C2)OCO3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C(C)C(=O)NC2=CC3=C(C=C2)OCO3)C)[N+](=O)[O-]

InChI

InChI=1S/C15H16N4O5/c1-8-14(19(21)22)9(2)18(17-8)10(3)15(20)16-11-4-5-12-13(6-11)24-7-23-12/h4-6,10H,7H2,1-3H3,(H,16,20)