N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3-methoxy-4-nitro-pyrazol-1-yl)propanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3-methoxy-4-nitro-pyrazol-1-yl)propanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3-methoxy-4-nitro-pyrazol-1-yl)propanamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3-methoxy-4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3-methoxy-4-nitropyrazol-1-yl)propanamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(3-methoxy-4-nitro-pyrazol-1-yl)propionamide Formula: C15H16N4O6 MolecularWeight: 348.31074

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NN(C=C1[N+](=O)[O-])CCC(=O)NC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

COC1=NN(C=C1[N+](=O)[O-])CCC(=O)NC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C15H16N4O6/c1-23-15-11(19(21)22)9-18(17-15)5-4-14(20)16-10-2-3-12-13(8-10)25-7-6-24-12/h2-3,8-9H,4-7H2,1H3,(H,16,20)