5-[1-oxidanyl-2-[6-(4-thiophen-2-ylbutoxy)hexylamino]ethyl]benzene-1,3-diol

Systemtic Name: 5-[1-oxidanyl-2-[6-(4-thiophen-2-ylbutoxy)hexylamino]ethyl]benzene-1,3-diol Openeye Name: 5-[1-hydroxy-2-[6-[4-(2-thienyl)butoxy]hexylamino]ethyl]benzene-1,3-diol CAS Name: 5-[1-hydroxy-2-[6-(4-thiophen-2-ylbutoxy)hexylamino]ethyl]benzene-1,3-diol IUPAC Name: 5-[1-hydroxy-2-[6-(4-thiophen-2-ylbutoxy)hexylamino]ethyl]benzene-1,3-diol Traditional Name: 5-[1-hydroxy-2-[6-[4-(2-thienyl)butoxy]hexylamino]ethyl]resorcinol Formula: C22H33NO4S MolecularWeight: 407.56672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CCCCOCCCCCCNCC(C2=CC(=CC(=C2)O)O)O

Isomeric SMILES

C1=CSC(=C1)CCCCOCCCCCCNCC(C2=CC(=CC(=C2)O)O)O

InChI

InChI=1S/C22H33NO4S/c24-19-14-18(15-20(25)16-19)22(26)17-23-10-4-1-2-5-11-27-12-6-3-8-21-9-7-13-28-21/h7,9,13-16,22-26H,1-6,8,10-12,17H2