(5-chloranyl-2-methoxy-phenyl)methyl-methyl-[2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl]azanium

Systemtic Name: (5-chloranyl-2-methoxy-phenyl)methyl-methyl-[2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl]azanium Openeye Name: (5-chloro-2-methoxy-phenyl)methyl-methyl-[2-oxo-2-[2-(2-thienyl)ethylamino]ethyl]ammonium CAS Name: (5-chloro-2-methoxyphenyl)methyl-methyl-[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]ammonium IUPAC Name: (5-chloro-2-methoxyphenyl)methyl-methyl-[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]azanium Traditional Name: (5-chloro-2-methoxy-benzyl)-[2-keto-2-[2-(2-thienyl)ethylamino]ethyl]-methyl-ammonium Formula: C17H22ClN2O2S+ MolecularWeight: 353.88678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21ClN2O2S/c1-20(11-13-10-14(18)5-6-16(13)22-2)12-17(21)19-8-7-15-4-3-9-23-15/h3-6,9-10H,7-8,11-12H2,1-2H3,(H,19,21)/p+1