N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-3-(4-nitropyrazol-1-yl)propanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-3-(4-nitropyrazol-1-yl)propanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-3-(4-nitropyrazol-1-yl)propanamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-3-(4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-3-(4-nitropyrazol-1-yl)propanamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-3-(4-nitropyrazol-1-yl)propionamide Formula: C15H16N4O5 MolecularWeight: 332.31134

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=C(C=N1)[N+](=O)[O-])C(=O)NC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC(CN1C=C(C=N1)[N+](=O)[O-])C(=O)NC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C15H16N4O5/c1-10(8-18-9-12(7-16-18)19(21)22)15(20)17-11-2-3-13-14(6-11)24-5-4-23-13/h2-3,6-7,9-10H,4-5,8H2,1H3,(H,17,20)