4-(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)carbonylpiperazine-1-carbaldehyde

Systemtic Name: 4-(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)carbonylpiperazine-1-carbaldehyde Openeye Name: 4-[4-chloro-3-(1-piperidylsulfonyl)benzoyl]piperazine-1-carbaldehyde CAS Name: 4-[[4-chloro-3-(1-piperidinylsulfonyl)phenyl]-oxomethyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-(4-chloro-3-piperidin-1-ylsulfonylbenzoyl)piperazine-1-carbaldehyde Traditional Name: 4-(4-chloro-3-piperidinosulfonyl-benzoyl)piperazine-1-carbaldehyde Formula: C17H22ClN3O4S MolecularWeight: 399.89228

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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