propyl (2S,4S)-3-(4-methyl-3-nitro-phenyl)carbonyl-2-propan-2-yl-1,3-thiazolidine-4-carboxylate

Systemtic Name: propyl (2S,4S)-3-(4-methyl-3-nitro-phenyl)carbonyl-2-propan-2-yl-1,3-thiazolidine-4-carboxylate Openeye Name: propyl (2S,4S)-2-isopropyl-3-(4-methyl-3-nitro-benzoyl)thiazolidine-4-carboxylate CAS Name: (2S,4S)-3-[(4-methyl-3-nitrophenyl)-oxomethyl]-2-propan-2-yl-4-thiazolidinecarboxylic acid propyl ester IUPAC Name: propyl (2S,4S)-3-(4-methyl-3-nitrobenzoyl)-2-propan-2-yl-1,3-thiazolidine-4-carboxylate Traditional Name: (2S,4S)-2-isopropyl-3-(4-methyl-3-nitro-benzoyl)thiazolidine-4-carboxylic acid propyl ester Formula: C18H24N2O5S MolecularWeight: 380.45856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1CSC(N1C(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-])C(C)C

Isomeric SMILES

CCCOC(=O)[C@H]1CS[C@H](N1C(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-])C(C)C

InChI

InChI=1S/C18H24N2O5S/c1-5-8-25-18(22)15-10-26-17(11(2)3)19(15)16(21)13-7-6-12(4)14(9-13)20(23)24/h6-7,9,11,15,17H,5,8,10H2,1-4H3/t15-,17+/m1/s1