butyl 4-[3-(4-chlorophenyl)sulfonylpropanoylamino]benzoate

Systemtic Name: butyl 4-[3-(4-chlorophenyl)sulfonylpropanoylamino]benzoate Openeye Name: butyl 4-[3-(4-chlorophenyl)sulfonylpropanoylamino]benzoate CAS Name: 4-[[3-(4-chlorophenyl)sulfonyl-1-oxopropyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[3-(4-chlorophenyl)sulfonylpropanoylamino]benzoate Traditional Name: 4-[3-(4-chlorophenyl)sulfonylpropanoylamino]benzoic acid butyl ester Formula: C20H22ClNO5S MolecularWeight: 423.91038

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CCS(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CCS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H22ClNO5S/c1-2-3-13-27-20(24)15-4-8-17(9-5-15)22-19(23)12-14-28(25,26)18-10-6-16(21)7-11-18/h4-11H,2-3,12-14H2,1H3,(H,22,23)