[(1R)-1-(3-methoxyphenyl)-2-[[(3S)-thiolan-3-yl]azaniumyl]ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-1-(3-methoxyphenyl)-2-[[(3S)-thiolan-3-yl]azaniumyl]ethyl]-dimethyl-azanium Openeye Name: [(1R)-1-(3-methoxyphenyl)-2-[[(3S)-tetrahydrothiophen-3-yl]ammonio]ethyl]-dimethyl-ammonium CAS Name: [(1R)-1-(3-methoxyphenyl)-2-[[(3S)-3-thiolanyl]ammonio]ethyl]-dimethylammonium IUPAC Name: [(1R)-1-(3-methoxyphenyl)-2-[[(3S)-thiolan-3-yl]azaniumyl]ethyl]-dimethylazanium Traditional Name: [(1R)-1-(3-methoxyphenyl)-2-[[(3S)-tetrahydrothiophen-3-yl]ammonio]ethyl]-dimethyl-ammonium Formula: C15H26N2OS+2 MolecularWeight: 282.44474

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(C[NH2+]C1CCSC1)C2=CC(=CC=C2)OC

Isomeric SMILES

C[NH+](C)[C@@H](C[NH2+][C@H]1CCSC1)C2=CC(=CC=C2)OC

InChI

InChI=1S/C15H24N2OS/c1-17(2)15(10-16-13-7-8-19-11-13)12-5-4-6-14(9-12)18-3/h4-6,9,13,15-16H,7-8,10-11H2,1-3H3/p+2/t13-,15-/m0/s1