butyl 4-[2-[ethyl-(5-fluoranyl-2-methoxy-phenyl)sulfonyl-amino]ethanoylamino]benzoate

Systemtic Name: butyl 4-[2-[ethyl-(5-fluoranyl-2-methoxy-phenyl)sulfonyl-amino]ethanoylamino]benzoate Openeye Name: butyl 4-[[2-[ethyl-(5-fluoro-2-methoxy-phenyl)sulfonyl-amino]acetyl]amino]benzoate CAS Name: 4-[[2-[ethyl-(5-fluoro-2-methoxyphenyl)sulfonylamino]-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-[ethyl-(5-fluoro-2-methoxyphenyl)sulfonylamino]acetyl]amino]benzoate Traditional Name: 4-[[2-[ethyl-(5-fluoro-2-methoxy-phenyl)sulfonyl-amino]acetyl]amino]benzoic acid butyl ester Formula: C22H27FN2O6S MolecularWeight: 466.522983

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CN(CC)S(=O)(=O)C2=C(C=CC(=C2)F)OC

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CN(CC)S(=O)(=O)C2=C(C=CC(=C2)F)OC

InChI

InChI=1S/C22H27FN2O6S/c1-4-6-13-31-22(27)16-7-10-18(11-8-16)24-21(26)15-25(5-2)32(28,29)20-14-17(23)9-12-19(20)30-3/h7-12,14H,4-6,13,15H2,1-3H3,(H,24,26)