(3-fluorophenyl)methyl 3-methyl-2-[(3-morpholin-4-ylsulfonylphenyl)carbonylamino]butanoate

Systemtic Name: (3-fluorophenyl)methyl 3-methyl-2-[(3-morpholin-4-ylsulfonylphenyl)carbonylamino]butanoate Openeye Name: (3-fluorophenyl)methyl 3-methyl-2-[(3-morpholinosulfonylbenzoyl)amino]butanoate CAS Name: 3-methyl-2-[[[3-(4-morpholinylsulfonyl)phenyl]-oxomethyl]amino]butanoic acid (3-fluorophenyl)methyl ester IUPAC Name: (3-fluorophenyl)methyl 3-methyl-2-[(3-morpholin-4-ylsulfonylbenzoyl)amino]butanoate Traditional Name: 3-methyl-2-[(3-morpholinosulfonylbenzoyl)amino]butyric acid (3-fluorobenzyl) ester Formula: C23H27FN2O6S MolecularWeight: 478.533683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=CC(=CC=C1)F)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC(C)C(C(=O)OCC1=CC(=CC=C1)F)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C23H27FN2O6S/c1-16(2)21(23(28)32-15-17-5-3-7-19(24)13-17)25-22(27)18-6-4-8-20(14-18)33(29,30)26-9-11-31-12-10-26/h3-8,13-14,16,21H,9-12,15H2,1-2H3,(H,25,27)