[1-[[2-(4-hydroxyphenyl)-2-oxidanyl-ethyl]amino]-3-(2-methoxyphenoxy)-1-oxidanyl-propan-2-yl] hydrogen sulfate

Systemtic Name: [1-[[2-(4-hydroxyphenyl)-2-oxidanyl-ethyl]amino]-3-(2-methoxyphenoxy)-1-oxidanyl-propan-2-yl] hydrogen sulfate Openeye Name: [2-hydroxy-2-[[2-hydroxy-2-(4-hydroxyphenyl)ethyl]amino]-1-[(2-methoxyphenoxy)methyl]ethyl] hydrogen sulfate CAS Name: sulfuric acid [1-hydroxy-1-[[2-hydroxy-2-(4-hydroxyphenyl)ethyl]amino]-3-(2-methoxyphenoxy)propan-2-yl] ester IUPAC Name: [1-hydroxy-1-[[2-hydroxy-2-(4-hydroxyphenyl)ethyl]amino]-3-(2-methoxyphenoxy)propan-2-yl] hydrogen sulfate Traditional Name: sulfuric acid [2-hydroxy-2-[[2-hydroxy-2-(4-hydroxyphenyl)ethyl]amino]-1-[(2-methoxyphenoxy)methyl]ethyl] ester Formula: C18H23NO9S MolecularWeight: 429.44152

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OCC(C(NCC(C2=CC=C(C=C2)O)O)O)OS(=O)(=O)O

Isomeric SMILES

COC1=CC=CC=C1OCC(C(NCC(C2=CC=C(C=C2)O)O)O)OS(=O)(=O)O

InChI

InChI=1S/C18H23NO9S/c1-26-15-4-2-3-5-16(15)27-11-17(28-29(23,24)25)18(22)19-10-14(21)12-6-8-13(20)9-7-12/h2-9,14,17-22H,10-11H2,1H3,(H,23,24,25)