(2,6-dimethylphenyl) 2-morpholin-4-yl-5-piperidin-1-ylsulfonyl-benzoate

Systemtic Name: (2,6-dimethylphenyl) 2-morpholin-4-yl-5-piperidin-1-ylsulfonyl-benzoate Openeye Name: (2,6-dimethylphenyl) 2-morpholino-5-(1-piperidylsulfonyl)benzoate CAS Name: 2-(4-morpholinyl)-5-(1-piperidinylsulfonyl)benzoic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) 2-morpholin-4-yl-5-piperidin-1-ylsulfonylbenzoate Traditional Name: 2-morpholino-5-piperidinosulfonyl-benzoic acid (2,6-dimethylphenyl) ester Formula: C24H30N2O5S MolecularWeight: 458.5704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H30N2O5S/c1-18-7-6-8-19(2)23(18)31-24(27)21-17-20(32(28,29)26-11-4-3-5-12-26)9-10-22(21)25-13-15-30-16-14-25/h6-10,17H,3-5,11-16H2,1-2H3