N-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]-4-ethanoyl-benzenesulfonamide

Systemtic Name: N-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]-4-ethanoyl-benzenesulfonamide Openeye Name: 4-acetyl-N-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]benzenesulfonamide CAS Name: 4-acetyl-N-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]benzenesulfonamide IUPAC Name: 4-acetyl-N-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]benzenesulfonamide Traditional Name: 4-acetyl-N-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]benzenesulfonamide Formula: C21H25NO5S MolecularWeight: 403.4919

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC2=C(C=C1)OCCCO2)NS(=O)(=O)C3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CC(C)[C@@H](C1=CC2=C(C=C1)OCCCO2)NS(=O)(=O)C3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C21H25NO5S/c1-14(2)21(17-7-10-19-20(13-17)27-12-4-11-26-19)22-28(24,25)18-8-5-16(6-9-18)15(3)23/h5-10,13-14,21-22H,4,11-12H2,1-3H3/t21-/m0/s1