butyl 3-(3-nitrophenyl)carbonyl-2-(phenylmethyl)-1,3-thiazolidine-4-carboxylate

Systemtic Name: butyl 3-(3-nitrophenyl)carbonyl-2-(phenylmethyl)-1,3-thiazolidine-4-carboxylate Openeye Name: butyl 2-benzyl-3-(3-nitrobenzoyl)thiazolidine-4-carboxylate CAS Name: 3-[(3-nitrophenyl)-oxomethyl]-2-(phenylmethyl)-4-thiazolidinecarboxylic acid butyl ester IUPAC Name: butyl 2-benzyl-3-(3-nitrobenzoyl)-1,3-thiazolidine-4-carboxylate Traditional Name: 2-benzyl-3-(3-nitrobenzoyl)thiazolidine-4-carboxylic acid butyl ester Formula: C22H24N2O5S MolecularWeight: 428.50136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1CSC(N1C(=O)C2=CC(=CC=C2)[N+](=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

CCCCOC(=O)C1CSC(N1C(=O)C2=CC(=CC=C2)[N+](=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C22H24N2O5S/c1-2-3-12-29-22(26)19-15-30-20(13-16-8-5-4-6-9-16)23(19)21(25)17-10-7-11-18(14-17)24(27)28/h4-11,14,19-20H,2-3,12-13,15H2,1H3