4-[[4-(4-bromanyl-2-fluoranyl-phenyl)phenyl]sulfonylamino]butyl ethanoate

Systemtic Name: 4-[[4-(4-bromanyl-2-fluoranyl-phenyl)phenyl]sulfonylamino]butyl ethanoate Openeye Name: 4-[[4-(4-bromo-2-fluoro-phenyl)phenyl]sulfonylamino]butyl acetate CAS Name: acetic acid 4-[[4-(4-bromo-2-fluorophenyl)phenyl]sulfonylamino]butyl ester IUPAC Name: 4-[[4-(4-bromo-2-fluorophenyl)phenyl]sulfonylamino]butyl acetate Traditional Name: acetic acid 4-[[4-(4-bromo-2-fluoro-phenyl)phenyl]sulfonylamino]butyl ester Formula: C18H19BrFNO4S MolecularWeight: 444.315163

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCCCNS(=O)(=O)C1=CC=C(C=C1)C2=C(C=C(C=C2)Br)F

Isomeric SMILES

CC(=O)OCCCCNS(=O)(=O)C1=CC=C(C=C1)C2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C18H19BrFNO4S/c1-13(22)25-11-3-2-10-21-26(23,24)16-7-4-14(5-8-16)17-9-6-15(19)12-18(17)20/h4-9,12,21H,2-3,10-11H2,1H3