4-[4-(phenylsulfonyl)piperazin-1-yl]benzaldehyde

Systemtic Name: 4-[4-(phenylsulfonyl)piperazin-1-yl]benzaldehyde Openeye Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]benzaldehyde CAS Name: 4-[4-(benzenesulfonyl)-1-piperazinyl]benzaldehyde IUPAC Name: 4-[4-(benzenesulfonyl)piperazin-1-yl]benzaldehyde Traditional Name: 4-(4-besylpiperazino)benzaldehyde Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)C=O)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)C=O)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H18N2O3S/c20-14-15-6-8-16(9-7-15)18-10-12-19(13-11-18)23(21,22)17-4-2-1-3-5-17/h1-9,14H,10-13H2