[(3R)-1-ethylpyrrolidin-1-ium-3-yl]methyl-methyl-[(3-phenethyl-2-propan-2-ylsulfonyl-imidazol-4-yl)methyl]azanium

Systemtic Name: [(3R)-1-ethylpyrrolidin-1-ium-3-yl]methyl-methyl-[(3-phenethyl-2-propan-2-ylsulfonyl-imidazol-4-yl)methyl]azanium Openeye Name: [(3R)-1-ethylpyrrolidin-1-ium-3-yl]methyl-[(2-isopropylsulfonyl-3-phenethyl-imidazol-4-yl)methyl]-methyl-ammonium CAS Name: [(3R)-1-ethyl-3-pyrrolidin-1-iumyl]methyl-methyl-[(3-phenethyl-2-propan-2-ylsulfonyl-4-imidazolyl)methyl]ammonium IUPAC Name: [(3R)-1-ethylpyrrolidin-1-ium-3-yl]methyl-methyl-[(3-phenethyl-2-propan-2-ylsulfonylimidazol-4-yl)methyl]azanium Traditional Name: [(3R)-1-ethylpyrrolidin-1-ium-3-yl]methyl-[(2-isopropylsulfonyl-3-phenethyl-imidazol-4-yl)methyl]-methyl-ammonium Formula: C23H38N4O2S+2 MolecularWeight: 434.63842

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(C1)C[NH+](C)CC2=CN=C(N2CCC3=CC=CC=C3)S(=O)(=O)C(C)C

Isomeric SMILES

CC[NH+]1CC[C@@H](C1)C[NH+](C)CC2=CN=C(N2CCC3=CC=CC=C3)S(=O)(=O)C(C)C

InChI

InChI=1S/C23H36N4O2S/c1-5-26-13-11-21(17-26)16-25(4)18-22-15-24-23(30(28,29)19(2)3)27(22)14-12-20-9-7-6-8-10-20/h6-10,15,19,21H,5,11-14,16-18H2,1-4H3/p+2/t21-/m1/s1