N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N,2,5-trimethyl-benzenesulfonamide

Systemtic Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N,2,5-trimethyl-benzenesulfonamide Openeye Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N,2,5-trimethyl-benzenesulfonamide CAS Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N,2,5-trimethylbenzenesulfonamide IUPAC Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N,2,5-trimethylbenzenesulfonamide Traditional Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N,2,5-trimethyl-benzenesulfonamide Formula: C18H21NO4S MolecularWeight: 347.42864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N(C)CC2COC3=CC=CC=C3O2

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N(C)C[C@H]2COC3=CC=CC=C3O2

InChI

InChI=1S/C18H21NO4S/c1-13-8-9-14(2)18(10-13)24(20,21)19(3)11-15-12-22-16-6-4-5-7-17(16)23-15/h4-10,15H,11-12H2,1-3H3/t15-/m0/s1