(4-iodophenyl)-[4-(phenylsulfonyl)piperazin-1-yl]methanone

Systemtic Name: (4-iodophenyl)-[4-(phenylsulfonyl)piperazin-1-yl]methanone Openeye Name: [4-(benzenesulfonyl)piperazin-1-yl]-(4-iodophenyl)methanone CAS Name: [4-(benzenesulfonyl)-1-piperazinyl]-(4-iodophenyl)methanone IUPAC Name: [4-(benzenesulfonyl)piperazin-1-yl]-(4-iodophenyl)methanone Traditional Name: (4-besylpiperazino)-(4-iodophenyl)methanone Formula: C17H17IN2O3S MolecularWeight: 456.29795

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=C(C=C2)I)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=C(C=C2)I)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H17IN2O3S/c18-15-8-6-14(7-9-15)17(21)19-10-12-20(13-11-19)24(22,23)16-4-2-1-3-5-16/h1-9H,10-13H2