N,N-dimethyl-4-[methylsulfanyl(morpholin-4-ium-4-ylidene)methyl]aniline iodide

Systemtic Name: N,N-dimethyl-4-[methylsulfanyl(morpholin-4-ium-4-ylidene)methyl]aniline iodide Openeye Name: N,N-dimethyl-4-[methylsulfanyl(morpholin-4-ium-4-ylidene)methyl]aniline iodide CAS Name: N,N-dimethyl-4-[(methylthio)-(4-morpholin-4-iumylidene)methyl]aniline iodide IUPAC Name: N,N-dimethyl-4-[methylsulfanyl(morpholin-4-ium-4-ylidene)methyl]aniline iodide Traditional Name: dimethyl-[4-[(methylthio)-morpholin-4-ium-4-ylidene-methyl]phenyl]amine iodide Formula: C14H21IN2OS MolecularWeight: 392.29881

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(=[N+]2CCOCC2)SC.[I-]

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(=[N+]2CCOCC2)SC.[I-]

InChI

InChI=1S/C14H21N2OS.HI/c1-15(2)13-6-4-12(5-7-13)14(18-3)16-8-10-17-11-9-16;/h4-7H,8-11H2,1-3H3;1H/q+1;/p-1