4-[4-[2-(3,4-dihydro-1H-isochromen-1-yl)ethyl]piperazin-1-yl]-N-methyl-benzenesulfonamide

Systemtic Name: 4-[4-[2-(3,4-dihydro-1H-isochromen-1-yl)ethyl]piperazin-1-yl]-N-methyl-benzenesulfonamide Openeye Name: 4-[4-(2-isochroman-1-ylethyl)piperazin-1-yl]-N-methyl-benzenesulfonamide CAS Name: 4-[4-[2-(3,4-dihydro-1H-2-benzopyran-1-yl)ethyl]-1-piperazinyl]-N-methylbenzenesulfonamide IUPAC Name: 4-[4-[2-(3,4-dihydro-1H-isochromen-1-yl)ethyl]piperazin-1-yl]-N-methylbenzenesulfonamide Traditional Name: 4-[4-(2-isochroman-1-ylethyl)piperazino]-N-methyl-benzenesulfonamide Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC=C(C=C1)N2CCN(CC2)CCC3C4=CC=CC=C4CCO3

Isomeric SMILES

CNS(=O)(=O)C1=CC=C(C=C1)N2CCN(CC2)CCC3C4=CC=CC=C4CCO3

InChI

InChI=1S/C22H29N3O3S/c1-23-29(26,27)20-8-6-19(7-9-20)25-15-13-24(14-16-25)12-10-22-21-5-3-2-4-18(21)11-17-28-22/h2-9,22-23H,10-17H2,1H3