ethyl 4-[[2,4-bis(chloranyl)-5-methyl-phenyl]sulfonyl-butyl-amino]benzoate

Systemtic Name: ethyl 4-[[2,4-bis(chloranyl)-5-methyl-phenyl]sulfonyl-butyl-amino]benzoate Openeye Name: ethyl 4-[butyl-(2,4-dichloro-5-methyl-phenyl)sulfonyl-amino]benzoate CAS Name: 4-[butyl-(2,4-dichloro-5-methylphenyl)sulfonylamino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[butyl-(2,4-dichloro-5-methylphenyl)sulfonylamino]benzoate Traditional Name: 4-[butyl-(2,4-dichloro-5-methyl-phenyl)sulfonyl-amino]benzoic acid ethyl ester Formula: C20H23Cl2NO4S MolecularWeight: 444.37192

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=CC=C(C=C1)C(=O)OCC)S(=O)(=O)C2=C(C=C(C(=C2)C)Cl)Cl

Isomeric SMILES

CCCCN(C1=CC=C(C=C1)C(=O)OCC)S(=O)(=O)C2=C(C=C(C(=C2)C)Cl)Cl

InChI

InChI=1S/C20H23Cl2NO4S/c1-4-6-11-23(16-9-7-15(8-10-16)20(24)27-5-2)28(25,26)19-12-14(3)17(21)13-18(19)22/h7-10,12-13H,4-6,11H2,1-3H3