(2-ethoxycarbonyl-4-fluoranyl-1-benzothiophen-3-yl)methyl-methyl-(2-morpholin-4-yl-2-oxidanylidene-ethyl)azanium

Systemtic Name: (2-ethoxycarbonyl-4-fluoranyl-1-benzothiophen-3-yl)methyl-methyl-(2-morpholin-4-yl-2-oxidanylidene-ethyl)azanium Openeye Name: (2-ethoxycarbonyl-4-fluoro-benzothiophen-3-yl)methyl-methyl-(2-morpholino-2-oxo-ethyl)ammonium CAS Name: (2-ethoxycarbonyl-4-fluoro-1-benzothiophen-3-yl)methyl-methyl-[2-(4-morpholinyl)-2-oxoethyl]ammonium IUPAC Name: (2-ethoxycarbonyl-4-fluoro-1-benzothiophen-3-yl)methyl-methyl-(2-morpholin-4-yl-2-oxoethyl)azanium Traditional Name: (2-carbethoxy-4-fluoro-benzothiophen-3-yl)methyl-(2-keto-2-morpholino-ethyl)-methyl-ammonium Formula: C19H24FN2O4S+ MolecularWeight: 395.468263

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)C[NH+](C)CC(=O)N3CCOCC3

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)C[NH+](C)CC(=O)N3CCOCC3

InChI

InChI=1S/C19H23FN2O4S/c1-3-26-19(24)18-13(17-14(20)5-4-6-15(17)27-18)11-21(2)12-16(23)22-7-9-25-10-8-22/h4-6H,3,7-12H2,1-2H3/p+1