methyl 4-[[(4-fluorophenyl)sulfonyl-phenyl-amino]methyl]benzoate

Systemtic Name: methyl 4-[[(4-fluorophenyl)sulfonyl-phenyl-amino]methyl]benzoate Openeye Name: methyl 4-[(N-(4-fluorophenyl)sulfonylanilino)methyl]benzoate CAS Name: 4-[(N-(4-fluorophenyl)sulfonylanilino)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(N-(4-fluorophenyl)sulfonylanilino)methyl]benzoate Traditional Name: 4-[(N-(4-fluorophenyl)sulfonylanilino)methyl]benzoic acid methyl ester Formula: C21H18FNO4S MolecularWeight: 399.435323

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN(C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN(C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H18FNO4S/c1-27-21(24)17-9-7-16(8-10-17)15-23(19-5-3-2-4-6-19)28(25,26)20-13-11-18(22)12-14-20/h2-14H,15H2,1H3