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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19FN2O5/c1-13-3-8-16(17(11-13)23(26)27)22-18(24)12-28-19(25)20(9-2-10-20)14-4-6-15(21)7-5-14/h3-8,11H,2,9-10,12H2,1H3,(H,22,24)