(2R,5S)-2-(3,4-dimethoxyphenyl)-5-methyl-3-(2-pyrrolidin-1-ium-1-ylethyl)-1,3-thiazolidin-4-one

Systemtic Name: (2R,5S)-2-(3,4-dimethoxyphenyl)-5-methyl-3-(2-pyrrolidin-1-ium-1-ylethyl)-1,3-thiazolidin-4-one Openeye Name: (2R,5S)-2-(3,4-dimethoxyphenyl)-5-methyl-3-(2-pyrrolidin-1-ium-1-ylethyl)thiazolidin-4-one CAS Name: (2R,5S)-2-(3,4-dimethoxyphenyl)-5-methyl-3-[2-(1-pyrrolidin-1-iumyl)ethyl]-4-thiazolidinone IUPAC Name: (2R,5S)-2-(3,4-dimethoxyphenyl)-5-methyl-3-(2-pyrrolidin-1-ium-1-ylethyl)-1,3-thiazolidin-4-one Traditional Name: (2R,5S)-2-(3,4-dimethoxyphenyl)-5-methyl-3-(2-pyrrolidin-1-ium-1-ylethyl)thiazolidin-4-one Formula: C18H27N2O3S+ MolecularWeight: 351.48358

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C(S1)C2=CC(=C(C=C2)OC)OC)CC[NH+]3CCCC3

Isomeric SMILES

C[C@H]1C(=O)N([C@H](S1)C2=CC(=C(C=C2)OC)OC)CC[NH+]3CCCC3

InChI

InChI=1S/C18H26N2O3S/c1-13-17(21)20(11-10-19-8-4-5-9-19)18(24-13)14-6-7-15(22-2)16(12-14)23-3/h6-7,12-13,18H,4-5,8-11H2,1-3H3/p+1/t13-,18+/m0/s1