(E)-2-(2-fluorophenyl)carbonyl-3-(3-methoxy-5-nitro-4-oxidanyl-phenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(2-fluorophenyl)carbonyl-3-(3-methoxy-5-nitro-4-oxidanyl-phenyl)prop-2-enenitrile Openeye Name: (E)-2-(2-fluorobenzoyl)-3-(4-hydroxy-3-methoxy-5-nitro-phenyl)prop-2-enenitrile CAS Name: (E)-2-[(2-fluorophenyl)-oxomethyl]-3-(4-hydroxy-3-methoxy-5-nitrophenyl)-2-propenenitrile IUPAC Name: (E)-2-(2-fluorobenzoyl)-3-(4-hydroxy-3-methoxy-5-nitrophenyl)prop-2-enenitrile Traditional Name: (E)-2-(2-fluorobenzoyl)-3-(4-hydroxy-3-methoxy-5-nitro-phenyl)acrylonitrile Formula: C17H11FN2O5 MolecularWeight: 342.278043

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)[N+](=O)[O-])C=C(C#N)C(=O)C2=CC=CC=C2F

Isomeric SMILES

COC1=CC(=CC(=C1O)[N+](=O)[O-])/C=C(\C#N)/C(=O)C2=CC=CC=C2F

InChI

InChI=1S/C17H11FN2O5/c1-25-15-8-10(7-14(17(15)22)20(23)24)6-11(9-19)16(21)12-4-2-3-5-13(12)18/h2-8,22H,1H3/b11-6+