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

Systemtic Name: N-[(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]-3,4-dimethoxy-benzenesulfonamide Openeye Name: N-[(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]-3,4-dimethoxy-benzenesulfonamide CAS Name: N-[(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]-3,4-dimethoxybenzenesulfonamide IUPAC Name: N-[(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]-3,4-dimethoxybenzenesulfonamide Traditional Name: N-[(1R)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]-3,4-dimethoxy-benzenesulfonamide Formula: C21H27NO6S MolecularWeight: 421.50718

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27NO6S/c1-14(2)21(15-6-8-18-20(12-15)28-11-5-10-27-18)22-29(23,24)16-7-9-17(25-3)19(13-16)26-4/h6-9,12-14,21-22H,5,10-11H2,1-4H3/t21-/m1/s1