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1-benzothiophen-3-ylmethyl-bis(2-hydroxyethyl)azanium

1-benzothiophen-3-ylmethyl-bis(2-hydroxyethyl)azanium

Systemtic Name:1-benzothiophen-3-ylmethyl-bis(2-hydroxyethyl)azanium
Openeye Name:benzothiophen-3-ylmethyl-bis(2-hydroxyethyl)ammonium
CAS Name:1-benzothiophen-3-ylmethyl-bis(2-hydroxyethyl)ammonium
IUPAC Name:1-benzothiophen-3-ylmethyl-bis(2-hydroxyethyl)azanium
Traditional Name:benzothiophen-3-ylmethyl-bis(2-hydroxyethyl)ammonium
Formula: C13H18NO2S+
MolecularWeight: 252.35252
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CS2)C[NH+](CCO)CCO


Isomeric SMILES

C1=CC=C2C(=C1)C(=CS2)C[NH+](CCO)CCO


InChI

InChI=1S/C13H17NO2S/c15-7-5-14(6-8-16)9-11-10-17-13-4-2-1-3-12(11)13/h1-4,10,15-16H,5-9H2/p+1


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