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

Systemtic Name: (4-chlorophenyl)methyl 3-methyl-2-[(3-morpholin-4-ylsulfonylphenyl)carbonylamino]butanoate Openeye Name: (4-chlorophenyl)methyl 3-methyl-2-[(3-morpholinosulfonylbenzoyl)amino]butanoate CAS Name: 3-methyl-2-[[[3-(4-morpholinylsulfonyl)phenyl]-oxomethyl]amino]butanoic acid (4-chlorophenyl)methyl ester IUPAC Name: (4-chlorophenyl)methyl 3-methyl-2-[(3-morpholin-4-ylsulfonylbenzoyl)amino]butanoate Traditional Name: 3-methyl-2-[(3-morpholinosulfonylbenzoyl)amino]butyric acid (4-chlorobenzyl) ester Formula: C23H27ClN2O6S MolecularWeight: 494.98828

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27ClN2O6S/c1-16(2)21(23(28)32-15-17-6-8-19(24)9-7-17)25-22(27)18-4-3-5-20(14-18)33(29,30)26-10-12-31-13-11-26/h3-9,14,16,21H,10-13,15H2,1-2H3,(H,25,27)