4-(2-chloranyl-5-piperidin-1-ylsulfonyl-phenyl)carbonylpiperazine-1-carbaldehyde

Systemtic Name: 4-(2-chloranyl-5-piperidin-1-ylsulfonyl-phenyl)carbonylpiperazine-1-carbaldehyde Openeye Name: 4-[2-chloro-5-(1-piperidylsulfonyl)benzoyl]piperazine-1-carbaldehyde CAS Name: 4-[[2-chloro-5-(1-piperidinylsulfonyl)phenyl]-oxomethyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-(2-chloro-5-piperidin-1-ylsulfonylbenzoyl)piperazine-1-carbaldehyde Traditional Name: 4-(2-chloro-5-piperidinosulfonyl-benzoyl)piperazine-1-carbaldehyde Formula: C17H22ClN3O4S MolecularWeight: 399.89228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)N3CCN(CC3)C=O

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)N3CCN(CC3)C=O

InChI

InChI=1S/C17H22ClN3O4S/c18-16-5-4-14(26(24,25)21-6-2-1-3-7-21)12-15(16)17(23)20-10-8-19(13-22)9-11-20/h4-5,12-13H,1-3,6-11H2