4-bromanyl-N-[(3-hydroxyphenyl)methyl]-2-methyl-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[(3-hydroxyphenyl)methyl]-2-methyl-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]benzenesulfonamide Openeye Name: 4-bromo-N-[(3-hydroxyphenyl)methyl]-2-methyl-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]benzenesulfonamide CAS Name: 4-bromo-N-[(3-hydroxyphenyl)methyl]-2-methyl-N-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]benzenesulfonamide IUPAC Name: 4-bromo-N-[(3-hydroxyphenyl)methyl]-2-methyl-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]benzenesulfonamide Traditional Name: 4-bromo-N-(3-hydroxybenzyl)-2-methyl-N-[4-(2-pyrrolidinoethoxy)phenyl]benzenesulfonamide Formula: C26H29BrN2O4S MolecularWeight: 545.48846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)S(=O)(=O)N(CC2=CC(=CC=C2)O)C3=CC=C(C=C3)OCCN4CCCC4

Isomeric SMILES

CC1=C(C=CC(=C1)Br)S(=O)(=O)N(CC2=CC(=CC=C2)O)C3=CC=C(C=C3)OCCN4CCCC4

InChI

InChI=1S/C26H29BrN2O4S/c1-20-17-22(27)7-12-26(20)34(31,32)29(19-21-5-4-6-24(30)18-21)23-8-10-25(11-9-23)33-16-15-28-13-2-3-14-28/h4-12,17-18,30H,2-3,13-16,19H2,1H3