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

Systemtic Name: (Z)-2-(3-fluorophenyl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enenitrile Openeye Name: (Z)-2-(3-fluorophenyl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enenitrile CAS Name: (Z)-2-(3-fluorophenyl)-3-(6-nitro-1,3-benzodioxol-5-yl)-2-propenenitrile IUPAC Name: (Z)-2-(3-fluorophenyl)-3-(6-nitro-1,3-benzodioxol-5-yl)prop-2-enenitrile Traditional Name: (Z)-2-(3-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=C3)F)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C16H9FN2O4/c17-13-3-1-2-10(5-13)12(8-18)4-11-6-15-16(23-9-22-15)7-14(11)19(20)21/h1-7H,9H2/b12-4+