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

Systemtic Name: (3,4-dimethylphenyl) 2-morpholin-4-yl-5-piperidin-1-ylsulfonyl-benzoate Openeye Name: (3,4-dimethylphenyl) 2-morpholino-5-(1-piperidylsulfonyl)benzoate CAS Name: 2-(4-morpholinyl)-5-(1-piperidinylsulfonyl)benzoic acid (3,4-dimethylphenyl) ester IUPAC Name: (3,4-dimethylphenyl) 2-morpholin-4-yl-5-piperidin-1-ylsulfonylbenzoate Traditional Name: 2-morpholino-5-piperidinosulfonyl-benzoic acid (3,4-dimethylphenyl) ester Formula: C24H30N2O5S MolecularWeight: 458.5704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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