2-[2-(1-benzothiophen-5-yl)ethoxy]-3-propyl-azetidin-3-ol nitrate

Systemtic Name: 2-[2-(1-benzothiophen-5-yl)ethoxy]-3-propyl-azetidin-3-ol nitrate Openeye Name: 2-[2-(benzothiophen-5-yl)ethoxy]-3-propyl-azetidin-3-ol nitrate CAS Name: 2-[2-(1-benzothiophen-5-yl)ethoxy]-3-propyl-3-azetidinol nitrate IUPAC Name: 2-[2-(1-benzothiophen-5-yl)ethoxy]-3-propylazetidin-3-ol nitrate Traditional Name: 2-[2-(benzothiophen-5-yl)ethoxy]-3-propyl-azetidin-3-ol nitrate Formula: C16H21N2O5S- MolecularWeight: 353.41334

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CNC1OCCC2=CC3=C(C=C2)SC=C3)O.[N+](=O)([O-])[O-]

Isomeric SMILES

CCCC1(CNC1OCCC2=CC3=C(C=C2)SC=C3)O.[N+](=O)([O-])[O-]

InChI

InChI=1S/C16H21NO2S.NO3/c1-2-7-16(18)11-17-15(16)19-8-5-12-3-4-14-13(10-12)6-9-20-14;2-1(3)4/h3-4,6,9-10,15,17-18H,2,5,7-8,11H2,1H3;/q;-1