[2-(cyclohexylamino)-2-oxidanylidene-ethyl] 3-[(5-fluoranyl-2-methyl-phenyl)sulfonylamino]benzoate

Systemtic Name: [2-(cyclohexylamino)-2-oxidanylidene-ethyl] 3-[(5-fluoranyl-2-methyl-phenyl)sulfonylamino]benzoate Openeye Name: [2-(cyclohexylamino)-2-oxo-ethyl] 3-[(5-fluoro-2-methyl-phenyl)sulfonylamino]benzoate CAS Name: 3-[(5-fluoro-2-methylphenyl)sulfonylamino]benzoic acid [2-(cyclohexylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclohexylamino)-2-oxoethyl] 3-[(5-fluoro-2-methylphenyl)sulfonylamino]benzoate Traditional Name: 3-[(5-fluoro-2-methyl-phenyl)sulfonylamino]benzoic acid [2-(cyclohexylamino)-2-keto-ethyl] ester Formula: C22H25FN2O5S MolecularWeight: 448.507703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)F)S(=O)(=O)NC2=CC=CC(=C2)C(=O)OCC(=O)NC3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)F)S(=O)(=O)NC2=CC=CC(=C2)C(=O)OCC(=O)NC3CCCCC3

InChI

InChI=1S/C22H25FN2O5S/c1-15-10-11-17(23)13-20(15)31(28,29)25-19-9-5-6-16(12-19)22(27)30-14-21(26)24-18-7-3-2-4-8-18/h5-6,9-13,18,25H,2-4,7-8,14H2,1H3,(H,24,26)