2-bromanyl-N-[4-chloranyl-3-[(3R)-pyrrolidin-3-yl]oxy-phenyl]-3,4-dimethoxy-benzenesulfonamide

Systemtic Name: 2-bromanyl-N-[4-chloranyl-3-[(3R)-pyrrolidin-3-yl]oxy-phenyl]-3,4-dimethoxy-benzenesulfonamide Openeye Name: 2-bromo-N-[4-chloro-3-[(3R)-pyrrolidin-3-yl]oxy-phenyl]-3,4-dimethoxy-benzenesulfonamide CAS Name: 2-bromo-N-[4-chloro-3-[[(3R)-3-pyrrolidinyl]oxy]phenyl]-3,4-dimethoxybenzenesulfonamide IUPAC Name: 2-bromo-N-[4-chloro-3-[(3R)-pyrrolidin-3-yl]oxyphenyl]-3,4-dimethoxybenzenesulfonamide Traditional Name: 2-bromo-N-[4-chloro-3-[(3R)-pyrrolidin-3-yl]oxy-phenyl]-3,4-dimethoxy-benzenesulfonamide Formula: C18H20BrClN2O5S MolecularWeight: 491.7838

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)Cl)OC3CCNC3)Br)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)S(=O)(=O)NC2=CC(=C(C=C2)Cl)O[C@@H]3CCNC3)Br)OC

InChI

InChI=1S/C18H20BrClN2O5S/c1-25-14-5-6-16(17(19)18(14)26-2)28(23,24)22-11-3-4-13(20)15(9-11)27-12-7-8-21-10-12/h3-6,9,12,21-22H,7-8,10H2,1-2H3/t12-/m1/s1