4-[2-[[3-(4-chloranyl-2-methyl-phenoxy)-2-oxidanyl-propyl]amino]ethyl]benzenesulfonamide

Systemtic Name: 4-[2-[[3-(4-chloranyl-2-methyl-phenoxy)-2-oxidanyl-propyl]amino]ethyl]benzenesulfonamide Openeye Name: 4-[2-[[3-(4-chloro-2-methyl-phenoxy)-2-hydroxy-propyl]amino]ethyl]benzenesulfonamide CAS Name: 4-[2-[[3-(4-chloro-2-methylphenoxy)-2-hydroxypropyl]amino]ethyl]benzenesulfonamide IUPAC Name: 4-[2-[[3-(4-chloro-2-methylphenoxy)-2-hydroxypropyl]amino]ethyl]benzenesulfonamide Traditional Name: 4-[2-[[3-(4-chloro-2-methyl-phenoxy)-2-hydroxy-propyl]amino]ethyl]benzenesulfonamide Formula: C18H23ClN2O4S MolecularWeight: 398.90422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCC(CNCCC2=CC=C(C=C2)S(=O)(=O)N)O

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCC(CNCCC2=CC=C(C=C2)S(=O)(=O)N)O

InChI

InChI=1S/C18H23ClN2O4S/c1-13-10-15(19)4-7-18(13)25-12-16(22)11-21-9-8-14-2-5-17(6-3-14)26(20,23)24/h2-7,10,16,21-22H,8-9,11-12H2,1H3,(H2,20,23,24)