N-(3-iodanylphenyl)-1-(phenylsulfonyl)piperidine-2-carboxamide

Systemtic Name: N-(3-iodanylphenyl)-1-(phenylsulfonyl)piperidine-2-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-(3-iodophenyl)piperidine-2-carboxamide CAS Name: 1-(benzenesulfonyl)-N-(3-iodophenyl)-2-piperidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-(3-iodophenyl)piperidine-2-carboxamide Traditional Name: 1-besyl-N-(3-iodophenyl)pipecolinamide Formula: C18H19IN2O3S MolecularWeight: 470.32453

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)NC2=CC(=CC=C2)I)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCN(C(C1)C(=O)NC2=CC(=CC=C2)I)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H19IN2O3S/c19-14-7-6-8-15(13-14)20-18(22)17-11-4-5-12-21(17)25(23,24)16-9-2-1-3-10-16/h1-3,6-10,13,17H,4-5,11-12H2,(H,20,22)