1-[(2S,5S)-5-methyl-3-(4-methylphenyl)sulfonyl-2-phenyl-imidazolidin-1-yl]-2-pyrrolidin-1-ium-1-yl-ethanone

Systemtic Name: 1-[(2S,5S)-5-methyl-3-(4-methylphenyl)sulfonyl-2-phenyl-imidazolidin-1-yl]-2-pyrrolidin-1-ium-1-yl-ethanone Openeye Name: 1-[(2S,5S)-5-methyl-2-phenyl-3-(p-tolylsulfonyl)imidazolidin-1-yl]-2-pyrrolidin-1-ium-1-yl-ethanone CAS Name: 1-[(2S,5S)-5-methyl-3-(4-methylphenyl)sulfonyl-2-phenyl-1-imidazolidinyl]-2-(1-pyrrolidin-1-iumyl)ethanone IUPAC Name: 1-[(2S,5S)-5-methyl-3-(4-methylphenyl)sulfonyl-2-phenylimidazolidin-1-yl]-2-pyrrolidin-1-ium-1-ylethanone Traditional Name: 1-[(2S,5S)-5-methyl-2-phenyl-3-tosyl-imidazolidin-1-yl]-2-pyrrolidin-1-ium-1-yl-ethanone Formula: C23H30N3O3S+ MolecularWeight: 428.5676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C(N1C(=O)C[NH+]2CCCC2)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

C[C@H]1CN([C@H](N1C(=O)C[NH+]2CCCC2)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C23H29N3O3S/c1-18-10-12-21(13-11-18)30(28,29)25-16-19(2)26(22(27)17-24-14-6-7-15-24)23(25)20-8-4-3-5-9-20/h3-5,8-13,19,23H,6-7,14-17H2,1-2H3/p+1/t19-,23+/m0/s1