4-(4-fluoranyl-5-methyl-2-nitro-phenyl)butanoate

Systemtic Name: 4-(4-fluoranyl-5-methyl-2-nitro-phenyl)butanoate Openeye Name: 4-(4-fluoro-5-methyl-2-nitro-phenyl)butanoate CAS Name: 4-(4-fluoro-5-methyl-2-nitrophenyl)butanoate IUPAC Name: 4-(4-fluoro-5-methyl-2-nitrophenyl)butanoate Traditional Name: 4-(4-fluoro-5-methyl-2-nitro-phenyl)butyrate Formula: C11H11FNO4- MolecularWeight: 240.207743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)CCCC(=O)[O-])[N+](=O)[O-])F

Isomeric SMILES

CC1=C(C=C(C(=C1)CCCC(=O)[O-])[N+](=O)[O-])F

InChI

InChI=1S/C11H12FNO4/c1-7-5-8(3-2-4-11(14)15)10(13(16)17)6-9(7)12/h5-6H,2-4H2,1H3,(H,14,15)/p-1