ethyl 2-(3-chlorophenyl)-3-(3,5,5-trimethylhexanoyl)-1,3-thiazolidine-4-carboxylate

Systemtic Name: ethyl 2-(3-chlorophenyl)-3-(3,5,5-trimethylhexanoyl)-1,3-thiazolidine-4-carboxylate Openeye Name: ethyl 2-(3-chlorophenyl)-3-(3,5,5-trimethylhexanoyl)thiazolidine-4-carboxylate CAS Name: 2-(3-chlorophenyl)-3-(3,5,5-trimethyl-1-oxohexyl)-4-thiazolidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(3-chlorophenyl)-3-(3,5,5-trimethylhexanoyl)-1,3-thiazolidine-4-carboxylate Traditional Name: 2-(3-chlorophenyl)-3-(3,5,5-trimethylhexanoyl)thiazolidine-4-carboxylic acid ethyl ester Formula: C21H30ClNO3S MolecularWeight: 411.9858

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CSC(N1C(=O)CC(C)CC(C)(C)C)C2=CC(=CC=C2)Cl

Isomeric SMILES

CCOC(=O)C1CSC(N1C(=O)CC(C)CC(C)(C)C)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C21H30ClNO3S/c1-6-26-20(25)17-13-27-19(15-8-7-9-16(22)11-15)23(17)18(24)10-14(2)12-21(3,4)5/h7-9,11,14,17,19H,6,10,12-13H2,1-5H3