1-[3-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]sulfonylphenyl]ethanone

Systemtic Name: 1-[3-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]sulfonylphenyl]ethanone Openeye Name: 1-[3-[[4-(azepane-1-carbonyl)-1-piperidyl]sulfonyl]phenyl]ethanone CAS Name: 1-[3-[[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]sulfonyl]phenyl]ethanone IUPAC Name: 1-[3-[4-(azepane-1-carbonyl)piperidin-1-yl]sulfonylphenyl]ethanone Traditional Name: 1-[3-[4-(azepane-1-carbonyl)piperidino]sulfonylphenyl]ethanone Formula: C20H28N2O4S MolecularWeight: 392.51232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCCCCC3

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCCCCC3

InChI

InChI=1S/C20H28N2O4S/c1-16(23)18-7-6-8-19(15-18)27(25,26)22-13-9-17(10-14-22)20(24)21-11-4-2-3-5-12-21/h6-8,15,17H,2-5,9-14H2,1H3