4-chloranyl-N-[(4-iodophenyl)methyl]-N-(2-oxidanylideneazepan-3-yl)benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[(4-iodophenyl)methyl]-N-(2-oxidanylideneazepan-3-yl)benzenesulfonamide Openeye Name: 4-chloro-N-[(4-iodophenyl)methyl]-N-(2-oxoazepan-3-yl)benzenesulfonamide CAS Name: 4-chloro-N-[(4-iodophenyl)methyl]-N-(2-oxo-3-azepanyl)benzenesulfonamide IUPAC Name: 4-chloro-N-[(4-iodophenyl)methyl]-N-(2-oxoazepan-3-yl)benzenesulfonamide Traditional Name: 4-chloro-N-(4-iodobenzyl)-N-(2-ketoazepan-3-yl)benzenesulfonamide Formula: C19H20ClIN2O3S MolecularWeight: 518.79617

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)N(CC2=CC=C(C=C2)I)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCNC(=O)C(C1)N(CC2=CC=C(C=C2)I)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H20ClIN2O3S/c20-15-6-10-17(11-7-15)27(25,26)23(13-14-4-8-16(21)9-5-14)18-3-1-2-12-22-19(18)24/h4-11,18H,1-3,12-13H2,(H,22,24)