dimethyl (2R,4S)-3-[2-(4-methylpiperazin-1-ium-1-yl)ethanoyl]-1,3-thiazolidine-2,4-dicarboxylate

Systemtic Name: dimethyl (2R,4S)-3-[2-(4-methylpiperazin-1-ium-1-yl)ethanoyl]-1,3-thiazolidine-2,4-dicarboxylate Openeye Name: dimethyl (2R,4S)-3-[2-(4-methylpiperazin-1-ium-1-yl)acetyl]thiazolidine-2,4-dicarboxylate CAS Name: (2R,4S)-3-[2-(4-methyl-1-piperazin-1-iumyl)-1-oxoethyl]thiazolidine-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (2R,4S)-3-[2-(4-methylpiperazin-1-ium-1-yl)acetyl]-1,3-thiazolidine-2,4-dicarboxylate Traditional Name: (2R,4S)-3-[2-(4-methylpiperazin-1-ium-1-yl)acetyl]thiazolidine-2,4-dicarboxylic acid dimethyl ester Formula: C14H24N3O5S+ MolecularWeight: 346.42246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CC[NH+](CC1)CC(=O)N2C(CSC2C(=O)OC)C(=O)OC

Isomeric SMILES

CN1CC[NH+](CC1)CC(=O)N2[C@H](CS[C@@H]2C(=O)OC)C(=O)OC

InChI

InChI=1S/C14H23N3O5S/c1-15-4-6-16(7-5-15)8-11(18)17-10(13(19)21-2)9-23-12(17)14(20)22-3/h10,12H,4-9H2,1-3H3/p+1/t10-,12-/m1/s1