(3,5-dimethylphenyl)methyl 2-morpholin-4-yl-5-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: (3,5-dimethylphenyl)methyl 2-morpholin-4-yl-5-piperidin-1-ylsulfonyl-benzoate Openeye Name: (3,5-dimethylphenyl)methyl 2-morpholino-5-(1-piperidylsulfonyl)benzoate CAS Name: 2-(4-morpholinyl)-5-(1-piperidinylsulfonyl)benzoic acid (3,5-dimethylphenyl)methyl ester IUPAC Name: (3,5-dimethylphenyl)methyl 2-morpholin-4-yl-5-piperidin-1-ylsulfonylbenzoate Traditional Name: 2-morpholino-5-piperidinosulfonyl-benzoic acid (3,5-dimethylbenzyl) ester Formula: C25H32N2O5S MolecularWeight: 472.59698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)N4CCOCC4)C

Isomeric SMILES

CC1=CC(=CC(=C1)COC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)N4CCOCC4)C

InChI

InChI=1S/C25H32N2O5S/c1-19-14-20(2)16-21(15-19)18-32-25(28)23-17-22(33(29,30)27-8-4-3-5-9-27)6-7-24(23)26-10-12-31-13-11-26/h6-7,14-17H,3-5,8-13,18H2,1-2H3