N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-nitro-2-(phenylmethyl)pyrazole-3-carboxamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-nitro-2-(phenylmethyl)pyrazole-3-carboxamide Openeye Name: 2-benzyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-nitro-pyrazole-3-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-nitro-2-(phenylmethyl)-3-pyrazolecarboxamide IUPAC Name: 2-benzyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-nitropyrazole-3-carboxamide Traditional Name: 2-benzyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-nitro-pyrazole-3-carboxamide Formula: C19H16N4O5 MolecularWeight: 380.35414

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC(=O)C3=CC(=NN3CC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC(=O)C3=CC(=NN3CC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H16N4O5/c24-19(20-14-6-7-16-17(10-14)28-9-8-27-16)15-11-18(23(25)26)21-22(15)12-13-4-2-1-3-5-13/h1-7,10-11H,8-9,12H2,(H,20,24)