2-[(2R,5S)-2-(3,4-dimethoxyphenyl)-5-methyl-4-oxidanylidene-1,3-thiazolidin-3-yl]ethyl-propan-2-yl-azanium

Systemtic Name: 2-[(2R,5S)-2-(3,4-dimethoxyphenyl)-5-methyl-4-oxidanylidene-1,3-thiazolidin-3-yl]ethyl-propan-2-yl-azanium Openeye Name: 2-[(2R,5S)-2-(3,4-dimethoxyphenyl)-5-methyl-4-oxo-thiazolidin-3-yl]ethyl-isopropyl-ammonium CAS Name: 2-[(2R,5S)-2-(3,4-dimethoxyphenyl)-5-methyl-4-oxo-3-thiazolidinyl]ethyl-propan-2-ylammonium IUPAC Name: 2-[(2R,5S)-2-(3,4-dimethoxyphenyl)-5-methyl-4-oxo-1,3-thiazolidin-3-yl]ethyl-propan-2-ylazanium Traditional Name: 2-[(2R,5S)-2-(3,4-dimethoxyphenyl)-4-keto-5-methyl-thiazolidin-3-yl]ethyl-isopropyl-ammonium Formula: C17H27N2O3S+ MolecularWeight: 339.47288

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C(S1)C2=CC(=C(C=C2)OC)OC)CC[NH2+]C(C)C

Isomeric SMILES

C[C@H]1C(=O)N([C@H](S1)C2=CC(=C(C=C2)OC)OC)CC[NH2+]C(C)C

InChI

InChI=1S/C17H26N2O3S/c1-11(2)18-8-9-19-16(20)12(3)23-17(19)13-6-7-14(21-4)15(10-13)22-5/h6-7,10-12,17-18H,8-9H2,1-5H3/p+1/t12-,17+/m0/s1