N-[1-(2-benzofuran-1-yl)ethyl]-2-bromanyl-4-piperidin-1-yl-benzenesulfonamide

Systemtic Name: N-[1-(2-benzofuran-1-yl)ethyl]-2-bromanyl-4-piperidin-1-yl-benzenesulfonamide Openeye Name: 2-bromo-N-(1-isobenzofuran-1-ylethyl)-4-(1-piperidyl)benzenesulfonamide CAS Name: 2-bromo-N-[1-(1-isobenzofuranyl)ethyl]-4-(1-piperidinyl)benzenesulfonamide IUPAC Name: N-[1-(2-benzofuran-1-yl)ethyl]-2-bromo-4-piperidin-1-ylbenzenesulfonamide Traditional Name: 2-bromo-N-(1-isobenzofuran-1-ylethyl)-4-piperidino-benzenesulfonamide Formula: C21H23BrN2O3S MolecularWeight: 463.38792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C2C=CC=CC2=CO1)NS(=O)(=O)C3=C(C=C(C=C3)N4CCCCC4)Br

Isomeric SMILES

CC(C1=C2C=CC=CC2=CO1)NS(=O)(=O)C3=C(C=C(C=C3)N4CCCCC4)Br

InChI

InChI=1S/C21H23BrN2O3S/c1-15(21-18-8-4-3-7-16(18)14-27-21)23-28(25,26)20-10-9-17(13-19(20)22)24-11-5-2-6-12-24/h3-4,7-10,13-15,23H,2,5-6,11-12H2,1H3