methyl-[2-oxidanylidene-2-[[(1S)-1-thiophen-2-ylethyl]amino]ethyl]-[(4-prop-2-enoxyphenyl)methyl]azanium

Systemtic Name: methyl-[2-oxidanylidene-2-[[(1S)-1-thiophen-2-ylethyl]amino]ethyl]-[(4-prop-2-enoxyphenyl)methyl]azanium Openeye Name: (4-allyloxyphenyl)methyl-methyl-[2-oxo-2-[[(1S)-1-(2-thienyl)ethyl]amino]ethyl]ammonium CAS Name: methyl-[2-oxo-2-[[(1S)-1-thiophen-2-ylethyl]amino]ethyl]-[(4-prop-2-enoxyphenyl)methyl]ammonium IUPAC Name: methyl-[2-oxo-2-[[(1S)-1-thiophen-2-ylethyl]amino]ethyl]-[(4-prop-2-enoxyphenyl)methyl]azanium Traditional Name: (4-allyloxybenzyl)-[2-keto-2-[[(1S)-1-(2-thienyl)ethyl]amino]ethyl]-methyl-ammonium Formula: C19H25N2O2S+ MolecularWeight: 345.479

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)NC(=O)C[NH+](C)CC2=CC=C(C=C2)OCC=C

Isomeric SMILES

C[C@@H](C1=CC=CS1)NC(=O)C[NH+](C)CC2=CC=C(C=C2)OCC=C

InChI

InChI=1S/C19H24N2O2S/c1-4-11-23-17-9-7-16(8-10-17)13-21(3)14-19(22)20-15(2)18-6-5-12-24-18/h4-10,12,15H,1,11,13-14H2,2-3H3,(H,20,22)/p+1/t15-/m0/s1