5-bromanyl-N-[(4-hydroxyphenyl)methyl]-2-methoxy-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]benzenesulfonamide

Systemtic Name: 5-bromanyl-N-[(4-hydroxyphenyl)methyl]-2-methoxy-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]benzenesulfonamide Openeye Name: 5-bromo-N-[(4-hydroxyphenyl)methyl]-2-methoxy-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]benzenesulfonamide CAS Name: 5-bromo-N-[(4-hydroxyphenyl)methyl]-2-methoxy-N-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]benzenesulfonamide IUPAC Name: 5-bromo-N-[(4-hydroxyphenyl)methyl]-2-methoxy-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]benzenesulfonamide Traditional Name: 5-bromo-N-(4-hydroxybenzyl)-2-methoxy-N-[4-(2-pyrrolidinoethoxy)phenyl]benzenesulfonamide Formula: C26H29BrN2O5S MolecularWeight: 561.48786

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)S(=O)(=O)N(CC2=CC=C(C=C2)O)C3=CC=C(C=C3)OCCN4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)Br)S(=O)(=O)N(CC2=CC=C(C=C2)O)C3=CC=C(C=C3)OCCN4CCCC4

InChI

InChI=1S/C26H29BrN2O5S/c1-33-25-13-6-21(27)18-26(25)35(31,32)29(19-20-4-9-23(30)10-5-20)22-7-11-24(12-8-22)34-17-16-28-14-2-3-15-28/h4-13,18,30H,2-3,14-17,19H2,1H3