N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-(3-ethanoylphenoxy)ethanamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-(3-ethanoylphenoxy)ethanamide Openeye Name: 2-(3-acetylphenoxy)-N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]acetamide CAS Name: 2-(3-acetylphenoxy)-N-[3-(1-azepanylsulfonyl)-4-methylphenyl]acetamide IUPAC Name: 2-(3-acetylphenoxy)-N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]acetamide Traditional Name: 2-(3-acetylphenoxy)-N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]acetamide Formula: C23H28N2O5S MolecularWeight: 444.54382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)COC2=CC=CC(=C2)C(=O)C)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)COC2=CC=CC(=C2)C(=O)C)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C23H28N2O5S/c1-17-10-11-20(15-22(17)31(28,29)25-12-5-3-4-6-13-25)24-23(27)16-30-21-9-7-8-19(14-21)18(2)26/h7-11,14-15H,3-6,12-13,16H2,1-2H3,(H,24,27)