propyl 5-[3-[6-[[2-[3-(hydroxymethyl)-4-oxidanyl-phenyl]-2-oxidanyl-ethyl]amino]hexoxy]propyl]thiophene-2-carboxylate hydrobromide

Systemtic Name: propyl 5-[3-[6-[[2-[3-(hydroxymethyl)-4-oxidanyl-phenyl]-2-oxidanyl-ethyl]amino]hexoxy]propyl]thiophene-2-carboxylate hydrobromide Openeye Name: propyl 5-[3-[6-[[2-hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]amino]hexoxy]propyl]thiophene-2-carboxylate hydrobromide CAS Name: 5-[3-[6-[[2-hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]amino]hexoxy]propyl]-2-thiophenecarboxylic acid propyl ester hydrobromide IUPAC Name: propyl 5-[3-[6-[[2-hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]amino]hexoxy]propyl]thiophene-2-carboxylate hydrobromide Traditional Name: 5-[3-[6-[[2-hydroxy-2-(4-hydroxy-3-methylol-phenyl)ethyl]amino]hexoxy]propyl]thiophene-2-carboxylic acid propyl ester hydrobromide Formula: C26H40BrNO6S MolecularWeight: 574.5679

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(S1)CCCOCCCCCCNCC(C2=CC(=C(C=C2)O)CO)O.Br

Isomeric SMILES

CCCOC(=O)C1=CC=C(S1)CCCOCCCCCCNCC(C2=CC(=C(C=C2)O)CO)O.Br

InChI

InChI=1S/C26H39NO6S.BrH/c1-2-14-33-26(31)25-12-10-22(34-25)8-7-16-32-15-6-4-3-5-13-27-18-24(30)20-9-11-23(29)21(17-20)19-28;/h9-12,17,24,27-30H,2-8,13-16,18-19H2,1H3;1H