(E)-N-[(4-fluorophenyl)methyl]-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide

Systemtic Name: (E)-N-[(4-fluorophenyl)methyl]-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide Openeye Name: (E)-N-[(4-fluorophenyl)methyl]-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide CAS Name: (E)-N-[(4-fluorophenyl)methyl]-3-(6-nitro-1,3-benzodioxol-5-yl)-2-propenamide IUPAC Name: (E)-N-[(4-fluorophenyl)methyl]-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enamide Traditional Name: (E)-N-(4-fluorobenzyl)-3-(6-nitro-1,3-benzodioxol-5-yl)acrylamide Formula: C17H13FN2O5 MolecularWeight: 344.293923

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C=CC(=O)NCC3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)/C=C/C(=O)NCC3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C17H13FN2O5/c18-13-4-1-11(2-5-13)9-19-17(21)6-3-12-7-15-16(25-10-24-15)8-14(12)20(22)23/h1-8H,9-10H2,(H,19,21)/b6-3+