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

Systemtic Name: dimethyl-[(1S)-1-phenyl-2-[[(3S)-thiolan-3-yl]azaniumyl]ethyl]azanium Openeye Name: dimethyl-[(1S)-1-phenyl-2-[[(3S)-tetrahydrothiophen-3-yl]ammonio]ethyl]ammonium CAS Name: dimethyl-[(1S)-1-phenyl-2-[[(3S)-3-thiolanyl]ammonio]ethyl]ammonium IUPAC Name: dimethyl-[(1S)-1-phenyl-2-[[(3S)-thiolan-3-yl]azaniumyl]ethyl]azanium Traditional Name: dimethyl-[(1S)-1-phenyl-2-[[(3S)-tetrahydrothiophen-3-yl]ammonio]ethyl]ammonium Formula: C14H24N2S+2 MolecularWeight: 252.41876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22N2S/c1-16(2)14(12-6-4-3-5-7-12)10-15-13-8-9-17-11-13/h3-7,13-15H,8-11H2,1-2H3/p+2/t13-,14+/m0/s1