(2S)-2-[(4-ethylphenyl)sulfonylmethyl]pyrrolidin-1-ium

Systemtic Name: (2S)-2-[(4-ethylphenyl)sulfonylmethyl]pyrrolidin-1-ium Openeye Name: (2S)-2-[(4-ethylphenyl)sulfonylmethyl]pyrrolidin-1-ium CAS Name: (2S)-2-[(4-ethylphenyl)sulfonylmethyl]pyrrolidin-1-ium IUPAC Name: (2S)-2-[(4-ethylphenyl)sulfonylmethyl]pyrrolidin-1-ium Traditional Name: (2S)-2-[(4-ethylphenyl)sulfonylmethyl]pyrrolidin-1-ium Formula: C13H20NO2S+ MolecularWeight: 254.3684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)CC2CCC[NH2+]2

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)C[C@@H]2CCC[NH2+]2

InChI

InChI=1S/C13H19NO2S/c1-2-11-5-7-13(8-6-11)17(15,16)10-12-4-3-9-14-12/h5-8,12,14H,2-4,9-10H2,1H3/p+1/t12-/m0/s1