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cyclooctyl-[[3-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]azanium

cyclooctyl-[[3-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]azanium

Systemtic Name:cyclooctyl-[[3-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]azanium
Openeye Name:cyclooctyl-[[3-ethoxy-4-(2-thienylmethoxy)phenyl]methyl]ammonium
CAS Name:cyclooctyl-[[3-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]ammonium
IUPAC Name:cyclooctyl-[[3-ethoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl]azanium
Traditional Name:cyclooctyl-[3-ethoxy-4-(2-thenyloxy)benzyl]ammonium
Formula: C22H32NO2S+
MolecularWeight: 374.55998
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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH2+]C2CCCCCCC2)OCC3=CC=CS3


Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH2+]C2CCCCCCC2)OCC3=CC=CS3


InChI

InChI=1S/C22H31NO2S/c1-2-24-22-15-18(16-23-19-9-6-4-3-5-7-10-19)12-13-21(22)25-17-20-11-8-14-26-20/h8,11-15,19,23H,2-7,9-10,16-17H2,1H3/p+1


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