(4-propan-2-ylphenyl) 4-chloranyl-3-(2,6-dimethylmorpholin-4-yl)sulfonyl-benzoate

Systemtic Name: (4-propan-2-ylphenyl) 4-chloranyl-3-(2,6-dimethylmorpholin-4-yl)sulfonyl-benzoate Openeye Name: (4-isopropylphenyl) 4-chloro-3-(2,6-dimethylmorpholin-4-yl)sulfonyl-benzoate CAS Name: 4-chloro-3-[(2,6-dimethyl-4-morpholinyl)sulfonyl]benzoic acid (4-propan-2-ylphenyl) ester IUPAC Name: (4-propan-2-ylphenyl) 4-chloro-3-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate Traditional Name: 4-chloro-3-(2,6-dimethylmorpholino)sulfonyl-benzoic acid p-cumenyl ester Formula: C22H26ClNO5S MolecularWeight: 451.96354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=CC=C(C=C3)C(C)C)Cl

Isomeric SMILES

CC1CN(CC(O1)C)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=CC=C(C=C3)C(C)C)Cl

InChI

InChI=1S/C22H26ClNO5S/c1-14(2)17-5-8-19(9-6-17)29-22(25)18-7-10-20(23)21(11-18)30(26,27)24-12-15(3)28-16(4)13-24/h5-11,14-16H,12-13H2,1-4H3