N-(1,3-benzodioxol-5-ylmethyl)-4-chloranyl-3-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-chloranyl-3-nitro-1H-pyrazole-5-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-chloro-3-nitro-1H-pyrazole-5-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-chloro-3-nitro-1H-pyrazole-5-carboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-chloro-3-nitro-1H-pyrazole-5-carboxamide Traditional Name: 4-chloro-3-nitro-N-piperonyl-1H-pyrazole-5-carboxamide Formula: C12H9ClN4O5 MolecularWeight: 324.67666

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=C(C(=NN3)[N+](=O)[O-])Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=C(C(=NN3)[N+](=O)[O-])Cl

InChI

InChI=1S/C12H9ClN4O5/c13-9-10(15-16-11(9)17(19)20)12(18)14-4-6-1-2-7-8(3-6)22-5-21-7/h1-3H,4-5H2,(H,14,18)(H,15,16)