N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(3,5-dimethylphenoxy)ethanamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(3,5-dimethylphenoxy)ethanamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(3,5-dimethylphenoxy)acetamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-2-(3,5-dimethylphenoxy)acetamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-2-(3,5-dimethylphenoxy)acetamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(3,5-dimethylphenoxy)acetamide Formula: C23H30N2O5S MolecularWeight: 446.5597

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC)C

InChI

InChI=1S/C23H30N2O5S/c1-17-12-18(2)14-19(13-17)30-16-23(26)24-21-15-20(8-9-22(21)29-3)31(27,28)25-10-6-4-5-7-11-25/h8-9,12-15H,4-7,10-11,16H2,1-3H3,(H,24,26)