[4-(4-fluorophenyl)-4-oxidanylidene-butyl] 2-[(4-acetamidophenyl)sulfonylamino]ethanoate

Systemtic Name: [4-(4-fluorophenyl)-4-oxidanylidene-butyl] 2-[(4-acetamidophenyl)sulfonylamino]ethanoate Openeye Name: [4-(4-fluorophenyl)-4-oxo-butyl] 2-[(4-acetamidophenyl)sulfonylamino]acetate CAS Name: 2-[(4-acetamidophenyl)sulfonylamino]acetic acid [4-(4-fluorophenyl)-4-oxobutyl] ester IUPAC Name: [4-(4-fluorophenyl)-4-oxobutyl] 2-[(4-acetamidophenyl)sulfonylamino]acetate Traditional Name: 2-[(4-acetamidophenyl)sulfonylamino]acetic acid [4-(4-fluorophenyl)-4-keto-butyl] ester Formula: C20H21FN2O6S MolecularWeight: 436.453943

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NCC(=O)OCCCC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NCC(=O)OCCCC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C20H21FN2O6S/c1-14(24)23-17-8-10-18(11-9-17)30(27,28)22-13-20(26)29-12-2-3-19(25)15-4-6-16(21)7-5-15/h4-11,22H,2-3,12-13H2,1H3,(H,23,24)