methyl 4-[4-[(4-fluorophenyl)sulfonylamino]butanoylamino]benzoate

Systemtic Name: methyl 4-[4-[(4-fluorophenyl)sulfonylamino]butanoylamino]benzoate Openeye Name: methyl 4-[4-[(4-fluorophenyl)sulfonylamino]butanoylamino]benzoate CAS Name: 4-[[4-[(4-fluorophenyl)sulfonylamino]-1-oxobutyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[4-[(4-fluorophenyl)sulfonylamino]butanoylamino]benzoate Traditional Name: 4-[4-[(4-fluorophenyl)sulfonylamino]butanoylamino]benzoic acid methyl ester Formula: C18H19FN2O5S MolecularWeight: 394.417263

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CCCNS(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CCCNS(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C18H19FN2O5S/c1-26-18(23)13-4-8-15(9-5-13)21-17(22)3-2-12-20-27(24,25)16-10-6-14(19)7-11-16/h4-11,20H,2-3,12H2,1H3,(H,21,22)