N-[(2-chloranyl-4-oxidanyl-phenyl)methyl]-4-methoxy-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]benzenesulfonamide

Systemtic Name: N-[(2-chloranyl-4-oxidanyl-phenyl)methyl]-4-methoxy-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]benzenesulfonamide Openeye Name: N-[(2-chloro-4-hydroxy-phenyl)methyl]-4-methoxy-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]benzenesulfonamide CAS Name: N-[(2-chloro-4-hydroxyphenyl)methyl]-4-methoxy-N-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]benzenesulfonamide IUPAC Name: N-[(2-chloro-4-hydroxyphenyl)methyl]-4-methoxy-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]benzenesulfonamide Traditional Name: N-(2-chloro-4-hydroxy-benzyl)-4-methoxy-N-[4-(2-pyrrolidinoethoxy)phenyl]benzenesulfonamide Formula: C26H29ClN2O5S MolecularWeight: 517.03686

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H29ClN2O5S/c1-33-23-10-12-25(13-11-23)35(31,32)29(19-20-4-7-22(30)18-26(20)27)21-5-8-24(9-6-21)34-17-16-28-14-2-3-15-28/h4-13,18,30H,2-3,14-17,19H2,1H3