4-[(3,4-dichlorophenyl)methylsulfonyl]piperazine-1-carbaldehyde

Systemtic Name: 4-[(3,4-dichlorophenyl)methylsulfonyl]piperazine-1-carbaldehyde Openeye Name: 4-[(3,4-dichlorophenyl)methylsulfonyl]piperazine-1-carbaldehyde CAS Name: 4-[(3,4-dichlorophenyl)methylsulfonyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-[(3,4-dichlorophenyl)methylsulfonyl]piperazine-1-carbaldehyde Traditional Name: 4-(3,4-dichlorobenzyl)sulfonylpiperazine-1-carbaldehyde Formula: C12H14Cl2N2O3S MolecularWeight: 337.22216

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C=O)S(=O)(=O)CC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

C1CN(CCN1C=O)S(=O)(=O)CC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C12H14Cl2N2O3S/c13-11-2-1-10(7-12(11)14)8-20(18,19)16-5-3-15(9-17)4-6-16/h1-2,7,9H,3-6,8H2