N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-methyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-methyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-methyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-methyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-methyl-4-nitropyrazole-3-carboxamide Traditional Name: N-[1-(1,3-benzodioxol-5-yl)ethyl]-1-methyl-4-nitro-pyrazole-3-carboxamide Formula: C14H14N4O5 MolecularWeight: 318.28476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCO2)NC(=O)C3=NN(C=C3[N+](=O)[O-])C

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCO2)NC(=O)C3=NN(C=C3[N+](=O)[O-])C

InChI

InChI=1S/C14H14N4O5/c1-8(9-3-4-11-12(5-9)23-7-22-11)15-14(19)13-10(18(20)21)6-17(2)16-13/h3-6,8H,7H2,1-2H3,(H,15,19)