N-[2-(azepan-1-yl)ethyl]-4-iodanyl-benzenesulfonamide

Systemtic Name: N-[2-(azepan-1-yl)ethyl]-4-iodanyl-benzenesulfonamide Openeye Name: N-[2-(azepan-1-yl)ethyl]-4-iodo-benzenesulfonamide CAS Name: N-[2-(1-azepanyl)ethyl]-4-iodobenzenesulfonamide IUPAC Name: N-[2-(azepan-1-yl)ethyl]-4-iodobenzenesulfonamide Traditional Name: N-[2-(azepan-1-yl)ethyl]-4-iodo-benzenesulfonamide Formula: C14H21IN2O2S MolecularWeight: 408.29821

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCNS(=O)(=O)C2=CC=C(C=C2)I

Isomeric SMILES

C1CCCN(CC1)CCNS(=O)(=O)C2=CC=C(C=C2)I

InChI

InChI=1S/C14H21IN2O2S/c15-13-5-7-14(8-6-13)20(18,19)16-9-12-17-10-3-1-2-4-11-17/h5-8,16H,1-4,9-12H2