N-[2-(azepan-1-yl)ethyl]-3-iodanyl-4-methoxy-N-methyl-benzenesulfonamide

Systemtic Name: N-[2-(azepan-1-yl)ethyl]-3-iodanyl-4-methoxy-N-methyl-benzenesulfonamide Openeye Name: N-[2-(azepan-1-yl)ethyl]-3-iodo-4-methoxy-N-methyl-benzenesulfonamide CAS Name: N-[2-(1-azepanyl)ethyl]-3-iodo-4-methoxy-N-methylbenzenesulfonamide IUPAC Name: N-[2-(azepan-1-yl)ethyl]-3-iodo-4-methoxy-N-methylbenzenesulfonamide Traditional Name: N-[2-(azepan-1-yl)ethyl]-3-iodo-4-methoxy-N-methyl-benzenesulfonamide Formula: C16H25IN2O3S MolecularWeight: 452.35077

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCN1CCCCCC1)S(=O)(=O)C2=CC(=C(C=C2)OC)I

Isomeric SMILES

CN(CCN1CCCCCC1)S(=O)(=O)C2=CC(=C(C=C2)OC)I

InChI

InChI=1S/C16H25IN2O3S/c1-18(11-12-19-9-5-3-4-6-10-19)23(20,21)14-7-8-16(22-2)15(17)13-14/h7-8,13H,3-6,9-12H2,1-2H3