[2-[(2-methyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 1-(4-fluorophenyl)cyclobutane-1-carboxylate

Systemtic Name: [2-[(2-methyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 1-(4-fluorophenyl)cyclobutane-1-carboxylate Openeye Name: [2-(2-methyl-3-nitro-anilino)-2-oxo-ethyl] 1-(4-fluorophenyl)cyclobutanecarboxylate CAS Name: 1-(4-fluorophenyl)-1-cyclobutanecarboxylic acid [2-(2-methyl-3-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-methyl-3-nitroanilino)-2-oxoethyl] 1-(4-fluorophenyl)cyclobutane-1-carboxylate Traditional Name: 1-(4-fluorophenyl)cyclobutanecarboxylic acid [2-keto-2-(2-methyl-3-nitro-anilino)ethyl] ester Formula: C20H19FN2O5 MolecularWeight: 386.373663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)COC(=O)C2(CCC2)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)COC(=O)C2(CCC2)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H19FN2O5/c1-13-16(4-2-5-17(13)23(26)27)22-18(24)12-28-19(25)20(10-3-11-20)14-6-8-15(21)9-7-14/h2,4-9H,3,10-12H2,1H3,(H,22,24)