propyl 3-(4-nitrophenyl)carbonyl-2-(3-phenoxyphenyl)-1,3-thiazolidine-4-carboxylate

Systemtic Name: propyl 3-(4-nitrophenyl)carbonyl-2-(3-phenoxyphenyl)-1,3-thiazolidine-4-carboxylate Openeye Name: propyl 3-(4-nitrobenzoyl)-2-(3-phenoxyphenyl)thiazolidine-4-carboxylate CAS Name: 3-[(4-nitrophenyl)-oxomethyl]-2-(3-phenoxyphenyl)-4-thiazolidinecarboxylic acid propyl ester IUPAC Name: propyl 3-(4-nitrobenzoyl)-2-(3-phenoxyphenyl)-1,3-thiazolidine-4-carboxylate Traditional Name: 3-(4-nitrobenzoyl)-2-(3-phenoxyphenyl)thiazolidine-4-carboxylic acid propyl ester Formula: C26H24N2O6S MolecularWeight: 492.54356

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1CSC(N1C(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC(=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

CCCOC(=O)C1CSC(N1C(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C26H24N2O6S/c1-2-15-33-26(30)23-17-35-25(27(23)24(29)18-11-13-20(14-12-18)28(31)32)19-7-6-10-22(16-19)34-21-8-4-3-5-9-21/h3-14,16,23,25H,2,15,17H2,1H3