2-(2-fluorophenyl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enenitrile

Systemtic Name: 2-(2-fluorophenyl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enenitrile Openeye Name: 2-(2-fluorophenyl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enenitrile CAS Name: 2-(2-fluorophenyl)-3-(6-nitro-1,3-benzodioxol-5-yl)-2-propenenitrile IUPAC Name: 2-(2-fluorophenyl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enenitrile Traditional Name: 2-(2-fluorophenyl)-3-(6-nitro-1,3-benzodioxol-5-yl)acrylonitrile Formula: C16H9FN2O4 MolecularWeight: 312.252063

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C=C(C#N)C3=CC=CC=C3F)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)C=C(C#N)C3=CC=CC=C3F)[N+](=O)[O-]

InChI

InChI=1S/C16H9FN2O4/c17-13-4-2-1-3-12(13)11(8-18)5-10-6-15-16(23-9-22-15)7-14(10)19(20)21/h1-7H,9H2