5-bromanyl-N-(2-cyanoethyl)-2-methoxy-N-propyl-benzenesulfonamide

Systemtic Name: 5-bromanyl-N-(2-cyanoethyl)-2-methoxy-N-propyl-benzenesulfonamide Openeye Name: 5-bromo-N-(2-cyanoethyl)-2-methoxy-N-propyl-benzenesulfonamide CAS Name: 5-bromo-N-(2-cyanoethyl)-2-methoxy-N-propylbenzenesulfonamide IUPAC Name: 5-bromo-N-(2-cyanoethyl)-2-methoxy-N-propylbenzenesulfonamide Traditional Name: 5-bromo-N-(2-cyanoethyl)-2-methoxy-N-propyl-benzenesulfonamide Formula: C13H17BrN2O3S MolecularWeight: 361.25468

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC#N)S(=O)(=O)C1=C(C=CC(=C1)Br)OC

Isomeric SMILES

CCCN(CCC#N)S(=O)(=O)C1=C(C=CC(=C1)Br)OC

InChI

InChI=1S/C13H17BrN2O3S/c1-3-8-16(9-4-7-15)20(17,18)13-10-11(14)5-6-12(13)19-2/h5-6,10H,3-4,8-9H2,1-2H3