3-(azepan-1-ylcarbonyl)-4-methoxy-N-(3-propan-2-yloxypropyl)benzenesulfonamide

Systemtic Name: 3-(azepan-1-ylcarbonyl)-4-methoxy-N-(3-propan-2-yloxypropyl)benzenesulfonamide Openeye Name: 3-(azepane-1-carbonyl)-N-(3-isopropoxypropyl)-4-methoxy-benzenesulfonamide CAS Name: 3-[1-azepanyl(oxo)methyl]-4-methoxy-N-(3-propan-2-yloxypropyl)benzenesulfonamide IUPAC Name: 3-(azepane-1-carbonyl)-4-methoxy-N-(3-propan-2-yloxypropyl)benzenesulfonamide Traditional Name: 3-(azepane-1-carbonyl)-N-(3-isopropoxypropyl)-4-methoxy-benzenesulfonamide Formula: C20H32N2O5S MolecularWeight: 412.54348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNS(=O)(=O)C1=CC(=C(C=C1)OC)C(=O)N2CCCCCC2

Isomeric SMILES

CC(C)OCCCNS(=O)(=O)C1=CC(=C(C=C1)OC)C(=O)N2CCCCCC2

InChI

InChI=1S/C20H32N2O5S/c1-16(2)27-14-8-11-21-28(24,25)17-9-10-19(26-3)18(15-17)20(23)22-12-6-4-5-7-13-22/h9-10,15-16,21H,4-8,11-14H2,1-3H3