N-[2-(3,4-dimethoxyphenyl)ethyl]-4-fluoranyl-3-nitro-benzamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-fluoranyl-3-nitro-benzamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-fluoro-3-nitro-benzamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-fluoro-3-nitrobenzamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-fluoro-3-nitrobenzamide Traditional Name: 4-fluoro-N-homoveratryl-3-nitro-benzamide Formula: C17H17FN2O5 MolecularWeight: 348.325683

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=CC(=C(C=C2)F)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=CC(=C(C=C2)F)[N+](=O)[O-])OC

InChI

InChI=1S/C17H17FN2O5/c1-24-15-6-3-11(9-16(15)25-2)7-8-19-17(21)12-4-5-13(18)14(10-12)20(22)23/h3-6,9-10H,7-8H2,1-2H3,(H,19,21)