1-[2-[(2-fluoranyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl]cyclohexane-1-carboxylic acid

Systemtic Name: 1-[2-[(2-fluoranyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethyl]cyclohexane-1-carboxylic acid Openeye Name: 1-[2-(2-fluoro-5-nitro-anilino)-2-oxo-ethyl]cyclohexanecarboxylic acid CAS Name: 1-[2-(2-fluoro-5-nitroanilino)-2-oxoethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 1-[2-(2-fluoro-5-nitroanilino)-2-oxoethyl]cyclohexane-1-carboxylic acid Traditional Name: 1-[2-(2-fluoro-5-nitro-anilino)-2-keto-ethyl]cyclohexanecarboxylic acid Formula: C15H17FN2O5 MolecularWeight: 324.304283

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])F)C(=O)O

Isomeric SMILES

C1CCC(CC1)(CC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])F)C(=O)O

InChI

InChI=1S/C15H17FN2O5/c16-11-5-4-10(18(22)23)8-12(11)17-13(19)9-15(14(20)21)6-2-1-3-7-15/h4-5,8H,1-3,6-7,9H2,(H,17,19)(H,20,21)