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

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-(4-propanoylphenoxy)ethanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-(4-propanoylphenoxy)acetamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-2-[4-(1-oxopropyl)phenoxy]acetamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-2-(4-propanoylphenoxy)acetamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-(4-propionylphenoxy)acetamide Formula: C24H30N2O5S MolecularWeight: 458.5704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H30N2O5S/c1-3-22(27)19-9-12-21(13-10-19)31-17-24(28)25-20-11-8-18(2)23(16-20)32(29,30)26-14-6-4-5-7-15-26/h8-13,16H,3-7,14-15,17H2,1-2H3,(H,25,28)