3-phenylpropyl (4R)-3-(3,3-dimethyl-2-oxidanylidene-butanoyl)-2,2-dimethyl-1,3-thiazolidine-4-carboxylate

Systemtic Name: 3-phenylpropyl (4R)-3-(3,3-dimethyl-2-oxidanylidene-butanoyl)-2,2-dimethyl-1,3-thiazolidine-4-carboxylate Openeye Name: 3-phenylpropyl (4R)-3-(3,3-dimethyl-2-oxo-butanoyl)-2,2-dimethyl-thiazolidine-4-carboxylate CAS Name: (4R)-3-(3,3-dimethyl-1,2-dioxobutyl)-2,2-dimethyl-4-thiazolidinecarboxylic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl (4R)-3-(3,3-dimethyl-2-oxobutanoyl)-2,2-dimethyl-1,3-thiazolidine-4-carboxylate Traditional Name: (4R)-3-(2-keto-3,3-dimethyl-butanoyl)-2,2-dimethyl-thiazolidine-4-carboxylic acid 3-phenylpropyl ester Formula: C21H29NO4S MolecularWeight: 391.52426

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Descriptors Computed from Structure

Canonical SMILES:

CC1(N(C(CS1)C(=O)OCCCC2=CC=CC=C2)C(=O)C(=O)C(C)(C)C)C

Isomeric SMILES

CC1(N([C@@H](CS1)C(=O)OCCCC2=CC=CC=C2)C(=O)C(=O)C(C)(C)C)C

InChI

InChI=1S/C21H29NO4S/c1-20(2,3)17(23)18(24)22-16(14-27-21(22,4)5)19(25)26-13-9-12-15-10-7-6-8-11-15/h6-8,10-11,16H,9,12-14H2,1-5H3/t16-/m0/s1