4-[(4-fluoranyl-3-nitro-phenyl)amino]butanoate

Systemtic Name: 4-[(4-fluoranyl-3-nitro-phenyl)amino]butanoate Openeye Name: 4-(4-fluoro-3-nitro-anilino)butanoate CAS Name: 4-(4-fluoro-3-nitroanilino)butanoate IUPAC Name: 4-(4-fluoro-3-nitroanilino)butanoate Traditional Name: 4-(4-fluoro-3-nitro-anilino)butyrate Formula: C10H10FN2O4- MolecularWeight: 241.195803

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NCCCC(=O)[O-])[N+](=O)[O-])F

Isomeric SMILES

C1=CC(=C(C=C1NCCCC(=O)[O-])[N+](=O)[O-])F

InChI

InChI=1S/C10H11FN2O4/c11-8-4-3-7(6-9(8)13(16)17)12-5-1-2-10(14)15/h3-4,6,12H,1-2,5H2,(H,14,15)/p-1