N,N-dimethyl-2,5-bis(thiolan-1-ium-1-ylmethyl)aniline dichloride

Systemtic Name: N,N-dimethyl-2,5-bis(thiolan-1-ium-1-ylmethyl)aniline dichloride Openeye Name: N,N-dimethyl-2,5-bis(tetrahydrothiophen-1-ium-1-ylmethyl)aniline dichloride CAS Name: N,N-dimethyl-2,5-bis(1-thiolan-1-iumylmethyl)aniline dichloride IUPAC Name: N,N-dimethyl-2,5-bis(thiolan-1-ium-1-ylmethyl)aniline dichloride Traditional Name: [2,5-bis(tetrahydrothiophen-1-ium-1-ylmethyl)phenyl]-dimethyl-amine dichloride Formula: C18H29Cl2NS2 MolecularWeight: 394.46556

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=CC(=C1)C[S+]2CCCC2)C[S+]3CCCC3.[Cl-].[Cl-]

Isomeric SMILES

CN(C)C1=C(C=CC(=C1)C[S+]2CCCC2)C[S+]3CCCC3.[Cl-].[Cl-]

InChI

InChI=1S/C18H29NS2.2ClH/c1-19(2)18-13-16(14-20-9-3-4-10-20)7-8-17(18)15-21-11-5-6-12-21;;/h7-8,13H,3-6,9-12,14-15H2,1-2H3;2*1H/q+2;;/p-2