N-(6-ethanoyl-1,3-benzodioxol-5-yl)-2-(4-nitro-2-prop-2-enyl-phenoxy)ethanamide

Systemtic Name: N-(6-ethanoyl-1,3-benzodioxol-5-yl)-2-(4-nitro-2-prop-2-enyl-phenoxy)ethanamide Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(2-allyl-4-nitro-phenoxy)acetamide CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(4-nitro-2-prop-2-enylphenoxy)acetamide IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(4-nitro-2-prop-2-enylphenoxy)acetamide Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-(2-allyl-4-nitro-phenoxy)acetamide Formula: C20H18N2O7 MolecularWeight: 398.36612

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=O)COC3=C(C=C(C=C3)[N+](=O)[O-])CC=C)OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)COC3=C(C=C(C=C3)[N+](=O)[O-])CC=C)OCO2

InChI

InChI=1S/C20H18N2O7/c1-3-4-13-7-14(22(25)26)5-6-17(13)27-10-20(24)21-16-9-19-18(28-11-29-19)8-15(16)12(2)23/h3,5-9H,1,4,10-11H2,2H3,(H,21,24)