N-[5-(azepan-1-ylsulfonyl)-2-chloranyl-phenyl]-2-(4-propanoylphenoxy)ethanamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-chloranyl-phenyl]-2-(4-propanoylphenoxy)ethanamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-chloro-phenyl]-2-(4-propanoylphenoxy)acetamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-chlorophenyl]-2-[4-(1-oxopropyl)phenoxy]acetamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-chlorophenyl]-2-(4-propanoylphenoxy)acetamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-chloro-phenyl]-2-(4-propionylphenoxy)acetamide Formula: C23H27ClN2O5S MolecularWeight: 478.98888

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27ClN2O5S/c1-2-22(27)17-7-9-18(10-8-17)31-16-23(28)25-21-15-19(11-12-20(21)24)32(29,30)26-13-5-3-4-6-14-26/h7-12,15H,2-6,13-14,16H2,1H3,(H,25,28)