N-[2-(3,4-dihydro-2H-chromen-2-ylmethylamino)ethyl]-4-fluoranyl-benzenesulfonamide hydrochloride

Systemtic Name: N-[2-(3,4-dihydro-2H-chromen-2-ylmethylamino)ethyl]-4-fluoranyl-benzenesulfonamide hydrochloride Openeye Name: N-[2-(chroman-2-ylmethylamino)ethyl]-4-fluoro-benzenesulfonamide hydrochloride CAS Name: N-[2-(3,4-dihydro-2H-1-benzopyran-2-ylmethylamino)ethyl]-4-fluorobenzenesulfonamide hydrochloride IUPAC Name: N-[2-(3,4-dihydro-2H-chromen-2-ylmethylamino)ethyl]-4-fluorobenzenesulfonamide hydrochloride Traditional Name: N-[2-(chroman-2-ylmethylamino)ethyl]-4-fluoro-benzenesulfonamide hydrochloride Formula: C18H22ClFN2O3S MolecularWeight: 400.895283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2OC1CNCCNS(=O)(=O)C3=CC=C(C=C3)F.Cl

Isomeric SMILES

C1CC2=CC=CC=C2OC1CNCCNS(=O)(=O)C3=CC=C(C=C3)F.Cl

InChI

InChI=1S/C18H21FN2O3S.ClH/c19-15-6-9-17(10-7-15)25(22,23)21-12-11-20-13-16-8-5-14-3-1-2-4-18(14)24-16;/h1-4,6-7,9-10,16,20-21H,5,8,11-13H2;1H