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

Systemtic Name: N-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]-3-ethanoyl-benzenesulfonamide Openeye Name: 3-acetyl-N-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]benzenesulfonamide CAS Name: 3-acetyl-N-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]benzenesulfonamide IUPAC Name: 3-acetyl-N-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]benzenesulfonamide Traditional Name: 3-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=CC(=C3)C(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C21H25NO5S/c1-14(2)21(17-8-9-19-20(13-17)27-11-5-10-26-19)22-28(24,25)18-7-4-6-16(12-18)15(3)23/h4,6-9,12-14,21-22H,5,10-11H2,1-3H3/t21-/m0/s1