N-[4-chloranyl-3-(1-methylpyrrolidin-3-yl)oxy-phenyl]-2,4,5-trimethoxy-benzenesulfonamide

Systemtic Name: N-[4-chloranyl-3-(1-methylpyrrolidin-3-yl)oxy-phenyl]-2,4,5-trimethoxy-benzenesulfonamide Openeye Name: N-[4-chloro-3-(1-methylpyrrolidin-3-yl)oxy-phenyl]-2,4,5-trimethoxy-benzenesulfonamide CAS Name: N-[4-chloro-3-[(1-methyl-3-pyrrolidinyl)oxy]phenyl]-2,4,5-trimethoxybenzenesulfonamide IUPAC Name: N-[4-chloro-3-(1-methylpyrrolidin-3-yl)oxyphenyl]-2,4,5-trimethoxybenzenesulfonamide Traditional Name: N-[4-chloro-3-(1-methylpyrrolidin-3-yl)oxy-phenyl]-2,4,5-trimethoxy-benzenesulfonamide Formula: C20H25ClN2O6S MolecularWeight: 456.9403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(C1)OC2=C(C=CC(=C2)NS(=O)(=O)C3=C(C=C(C(=C3)OC)OC)OC)Cl

Isomeric SMILES

CN1CCC(C1)OC2=C(C=CC(=C2)NS(=O)(=O)C3=C(C=C(C(=C3)OC)OC)OC)Cl

InChI

InChI=1S/C20H25ClN2O6S/c1-23-8-7-14(12-23)29-16-9-13(5-6-15(16)21)22-30(24,25)20-11-18(27-3)17(26-2)10-19(20)28-4/h5-6,9-11,14,22H,7-8,12H2,1-4H3