[2-[(4-chloranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-(4-fluoranylphenoxy)-2-methyl-propanoate

Systemtic Name: [2-[(4-chloranyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-(4-fluoranylphenoxy)-2-methyl-propanoate Openeye Name: [2-(4-chloro-3-nitro-anilino)-2-oxo-ethyl] 2-(4-fluorophenoxy)-2-methyl-propanoate CAS Name: 2-(4-fluorophenoxy)-2-methylpropanoic acid [2-(4-chloro-3-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-chloro-3-nitroanilino)-2-oxoethyl] 2-(4-fluorophenoxy)-2-methylpropanoate Traditional Name: 2-(4-fluorophenoxy)-2-methyl-propionic acid [2-(4-chloro-3-nitro-anilino)-2-keto-ethyl] ester Formula: C18H16ClFN2O6 MolecularWeight: 410.780843

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)OCC(=O)NC1=CC(=C(C=C1)Cl)[N+](=O)[O-])OC2=CC=C(C=C2)F

Isomeric SMILES

CC(C)(C(=O)OCC(=O)NC1=CC(=C(C=C1)Cl)[N+](=O)[O-])OC2=CC=C(C=C2)F

InChI

InChI=1S/C18H16ClFN2O6/c1-18(2,28-13-6-3-11(20)4-7-13)17(24)27-10-16(23)21-12-5-8-14(19)15(9-12)22(25)26/h3-9H,10H2,1-2H3,(H,21,23)