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1-[3-azanyl-5-(1-sulfoethoxy)phenoxy]ethanesulfonic acid

1-[3-azanyl-5-(1-sulfoethoxy)phenoxy]ethanesulfonic acid

Systemtic Name:1-[3-azanyl-5-(1-sulfoethoxy)phenoxy]ethanesulfonic acid
Openeye Name:1-[3-amino-5-(1-sulfoethoxy)phenoxy]ethanesulfonic acid
CAS Name:1-[3-amino-5-(1-sulfoethoxy)phenoxy]ethanesulfonic acid
IUPAC Name:1-[3-amino-5-(1-sulfoethoxy)phenoxy]ethanesulfonic acid
Traditional Name:1-[3-amino-5-(1-sulfoethoxy)phenoxy]ethanesulfonic acid
Formula: C10H15NO8S2
MolecularWeight: 341.358
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Descriptors Computed from Structure

Canonical SMILES:

CC(OC1=CC(=CC(=C1)N)OC(C)S(=O)(=O)O)S(=O)(=O)O


Isomeric SMILES

CC(OC1=CC(=CC(=C1)N)OC(C)S(=O)(=O)O)S(=O)(=O)O


InChI

InChI=1S/C10H15NO8S2/c1-6(20(12,13)14)18-9-3-8(11)4-10(5-9)19-7(2)21(15,16)17/h3-7H,11H2,1-2H3,(H,12,13,14)(H,15,16,17)


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