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

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(4-propanoylphenoxy)ethanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(4-propanoylphenoxy)acetamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-2-[4-(1-oxopropyl)phenoxy]acetamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(4-propanoylphenoxy)acetamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(4-propionylphenoxy)acetamide Formula: C23H28N2O5S MolecularWeight: 444.54382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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