methyl-[2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl]-[(4-prop-2-enoxyphenyl)methyl]azanium

Systemtic Name: methyl-[2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl]-[(4-prop-2-enoxyphenyl)methyl]azanium Openeye Name: (4-allyloxyphenyl)methyl-methyl-[2-oxo-2-[2-(2-thienyl)ethylamino]ethyl]ammonium CAS Name: methyl-[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]-[(4-prop-2-enoxyphenyl)methyl]ammonium IUPAC Name: methyl-[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]-[(4-prop-2-enoxyphenyl)methyl]azanium Traditional Name: (4-allyloxybenzyl)-[2-keto-2-[2-(2-thienyl)ethylamino]ethyl]-methyl-ammonium Formula: C19H25N2O2S+ MolecularWeight: 345.479

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)OCC=C)CC(=O)NCCC2=CC=CS2

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)OCC=C)CC(=O)NCCC2=CC=CS2

InChI

InChI=1S/C19H24N2O2S/c1-3-12-23-17-8-6-16(7-9-17)14-21(2)15-19(22)20-11-10-18-5-4-13-24-18/h3-9,13H,1,10-12,14-15H2,2H3,(H,20,22)/p+1