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

Systemtic Name: N-[4-(3,4-dihydro-2H-chromen-2-ylmethylamino)butyl]-4-fluoranyl-benzenesulfonamide hydrochloride Openeye Name: N-[4-(chroman-2-ylmethylamino)butyl]-4-fluoro-benzenesulfonamide hydrochloride CAS Name: N-[4-(3,4-dihydro-2H-1-benzopyran-2-ylmethylamino)butyl]-4-fluorobenzenesulfonamide hydrochloride IUPAC Name: N-[4-(3,4-dihydro-2H-chromen-2-ylmethylamino)butyl]-4-fluorobenzenesulfonamide hydrochloride Traditional Name: N-[4-(chroman-2-ylmethylamino)butyl]-4-fluoro-benzenesulfonamide hydrochloride Formula: C20H26ClFN2O3S MolecularWeight: 428.948443

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2OC1CNCCCCNS(=O)(=O)C3=CC=C(C=C3)F.Cl

Isomeric SMILES

C1CC2=CC=CC=C2OC1CNCCCCNS(=O)(=O)C3=CC=C(C=C3)F.Cl

InChI

InChI=1S/C20H25FN2O3S.ClH/c21-17-8-11-19(12-9-17)27(24,25)23-14-4-3-13-22-15-18-10-7-16-5-1-2-6-20(16)26-18;/h1-2,5-6,8-9,11-12,18,22-23H,3-4,7,10,13-15H2;1H