5-[[(2S)-2-(2-methoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]-1-(3-methoxypropyl)-2-methylsulfonyl-imidazole

Systemtic Name: 5-[[(2S)-2-(2-methoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]-1-(3-methoxypropyl)-2-methylsulfonyl-imidazole Openeye Name: 5-[[(2S)-2-(2-methoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]-1-(3-methoxypropyl)-2-methylsulfonyl-imidazole CAS Name: 5-[[(2S)-2-(2-methoxyphenyl)-1-pyrrolidin-1-iumyl]methyl]-1-(3-methoxypropyl)-2-methylsulfonylimidazole IUPAC Name: 5-[[(2S)-2-(2-methoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]-1-(3-methoxypropyl)-2-methylsulfonylimidazole Traditional Name: 2-mesyl-5-[[(2S)-2-(2-methoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]-1-(3-methoxypropyl)imidazole Formula: C20H30N3O4S+ MolecularWeight: 408.5349

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=CN=C1S(=O)(=O)C)C[NH+]2CCCC2C3=CC=CC=C3OC

Isomeric SMILES

COCCCN1C(=CN=C1S(=O)(=O)C)C[NH+]2CCC[C@H]2C3=CC=CC=C3OC

InChI

InChI=1S/C20H29N3O4S/c1-26-13-7-12-23-16(14-21-20(23)28(3,24)25)15-22-11-6-9-18(22)17-8-4-5-10-19(17)27-2/h4-5,8,10,14,18H,6-7,9,11-13,15H2,1-3H3/p+1/t18-/m0/s1