[(Z)-3-(4-fluoranyl-3-nitro-phenyl)prop-2-enyl] 3-(3-oxidanyl-4-phenylmethoxy-phenyl)propanoate

Systemtic Name: [(Z)-3-(4-fluoranyl-3-nitro-phenyl)prop-2-enyl] 3-(3-oxidanyl-4-phenylmethoxy-phenyl)propanoate Openeye Name: [(Z)-3-(4-fluoro-3-nitro-phenyl)allyl] 3-(4-benzyloxy-3-hydroxy-phenyl)propanoate CAS Name: 3-(3-hydroxy-4-phenylmethoxyphenyl)propanoic acid [(Z)-3-(4-fluoro-3-nitrophenyl)prop-2-enyl] ester IUPAC Name: [(Z)-3-(4-fluoro-3-nitrophenyl)prop-2-enyl] 3-(3-hydroxy-4-phenylmethoxyphenyl)propanoate Traditional Name: 3-(4-benzoxy-3-hydroxy-phenyl)propionic acid [(Z)-3-(4-fluoro-3-nitro-phenyl)allyl] ester Formula: C25H22FNO6 MolecularWeight: 451.443683

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)CCC(=O)OCC=CC3=CC(=C(C=C3)F)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)CCC(=O)OC/C=C\C3=CC(=C(C=C3)F)[N+](=O)[O-])O

InChI

InChI=1S/C25H22FNO6/c26-21-11-8-18(15-22(21)27(30)31)7-4-14-32-25(29)13-10-19-9-12-24(23(28)16-19)33-17-20-5-2-1-3-6-20/h1-9,11-12,15-16,28H,10,13-14,17H2/b7-4-