tert-butyl-[3-[(2-ethoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)oxy]-2-oxidanyl-propyl]azanium chloride

Systemtic Name: tert-butyl-[3-[(2-ethoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)oxy]-2-oxidanyl-propyl]azanium chloride Openeye Name: tert-butyl-[3-[(2-ethoxycarbonyl-4,5,6,7-tetrahydrobenzothiophen-3-yl)oxy]-2-hydroxy-propyl]ammonium chloride CAS Name: tert-butyl-[3-[(2-ethoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)oxy]-2-hydroxypropyl]ammonium chloride IUPAC Name: tert-butyl-[3-[(2-ethoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)oxy]-2-hydroxypropyl]azanium chloride Traditional Name: tert-butyl-[3-[(2-carbethoxy-4,5,6,7-tetrahydrobenzothiophen-3-yl)oxy]-2-hydroxy-propyl]ammonium chloride Formula: C18H30ClNO4S MolecularWeight: 391.9531

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)CCCC2)OCC(C[NH2+]C(C)(C)C)O.[Cl-]

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)CCCC2)OCC(C[NH2+]C(C)(C)C)O.[Cl-]

InChI

InChI=1S/C18H29NO4S.ClH/c1-5-22-17(21)16-15(13-8-6-7-9-14(13)24-16)23-11-12(20)10-19-18(2,3)4;/h12,19-20H,5-11H2,1-4H3;1H