2-ethylsulfonyl-1-(2-methoxyethyl)-5-[[(2S)-2-(2-methoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]imidazole

Systemtic Name: 2-ethylsulfonyl-1-(2-methoxyethyl)-5-[[(2S)-2-(2-methoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]imidazole Openeye Name: 2-ethylsulfonyl-1-(2-methoxyethyl)-5-[[(2S)-2-(2-methoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]imidazole CAS Name: 2-ethylsulfonyl-1-(2-methoxyethyl)-5-[[(2S)-2-(2-methoxyphenyl)-1-pyrrolidin-1-iumyl]methyl]imidazole IUPAC Name: 2-ethylsulfonyl-1-(2-methoxyethyl)-5-[[(2S)-2-(2-methoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]imidazole Traditional Name: 2-esyl-1-(2-methoxyethyl)-5-[[(2S)-2-(2-methoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]imidazole Formula: C20H30N3O4S+ MolecularWeight: 408.5349

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=NC=C(N1CCOC)C[NH+]2CCCC2C3=CC=CC=C3OC

Isomeric SMILES

CCS(=O)(=O)C1=NC=C(N1CCOC)C[NH+]2CCC[C@H]2C3=CC=CC=C3OC

InChI

InChI=1S/C20H29N3O4S/c1-4-28(24,25)20-21-14-16(23(20)12-13-26-2)15-22-11-7-9-18(22)17-8-5-6-10-19(17)27-3/h5-6,8,10,14,18H,4,7,9,11-13,15H2,1-3H3/p+1/t18-/m0/s1