N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-yl-ethyl]-4-methylsulfonyl-benzamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-yl-ethyl]-4-methylsulfonyl-benzamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)-2-morpholino-ethyl]-4-methylsulfonyl-benzamide CAS Name: N-[2-(3,4-dimethoxyphenyl)-2-(4-morpholinyl)ethyl]-4-methylsulfonylbenzamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)-2-morpholin-4-ylethyl]-4-methylsulfonylbenzamide Traditional Name: N-[2-(3,4-dimethoxyphenyl)-2-morpholino-ethyl]-4-mesyl-benzamide Formula: C22H28N2O6S MolecularWeight: 448.53252

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CNC(=O)C2=CC=C(C=C2)S(=O)(=O)C)N3CCOCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(CNC(=O)C2=CC=C(C=C2)S(=O)(=O)C)N3CCOCC3)OC

InChI

InChI=1S/C22H28N2O6S/c1-28-20-9-6-17(14-21(20)29-2)19(24-10-12-30-13-11-24)15-23-22(25)16-4-7-18(8-5-16)31(3,26)27/h4-9,14,19H,10-13,15H2,1-3H3,(H,23,25)