methyl 2-[[2-(2-fluorophenyl)carbonyl-4-nitro-phenyl]-(4-methylphenyl)sulfonyl-amino]ethanoate

Systemtic Name: methyl 2-[[2-(2-fluorophenyl)carbonyl-4-nitro-phenyl]-(4-methylphenyl)sulfonyl-amino]ethanoate Openeye Name: methyl 2-[2-(2-fluorobenzoyl)-4-nitro-N-(p-tolylsulfonyl)anilino]acetate CAS Name: 2-[2-[(2-fluorophenyl)-oxomethyl]-N-(4-methylphenyl)sulfonyl-4-nitroanilino]acetic acid methyl ester IUPAC Name: methyl 2-[2-(2-fluorobenzoyl)-N-(4-methylphenyl)sulfonyl-4-nitroanilino]acetate Traditional Name: 2-[2-(2-fluorobenzoyl)-4-nitro-N-tosyl-anilino]acetic acid methyl ester Formula: C23H19FN2O7S MolecularWeight: 486.469563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)OC)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CC=C3F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)OC)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CC=C3F

InChI

InChI=1S/C23H19FN2O7S/c1-15-7-10-17(11-8-15)34(31,32)25(14-22(27)33-2)21-12-9-16(26(29)30)13-19(21)23(28)18-5-3-4-6-20(18)24/h3-13H,14H2,1-2H3