propan-2-yl 3-[(E)-3-(4-nitrophenyl)prop-2-enoyl]-2-phenethyl-1,3-thiazolidine-4-carboxylate

Systemtic Name: propan-2-yl 3-[(E)-3-(4-nitrophenyl)prop-2-enoyl]-2-phenethyl-1,3-thiazolidine-4-carboxylate Openeye Name: isopropyl 3-[(E)-3-(4-nitrophenyl)prop-2-enoyl]-2-phenethyl-thiazolidine-4-carboxylate CAS Name: 3-[(E)-3-(4-nitrophenyl)-1-oxoprop-2-enyl]-2-phenethyl-4-thiazolidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[(E)-3-(4-nitrophenyl)prop-2-enoyl]-2-phenethyl-1,3-thiazolidine-4-carboxylate Traditional Name: 3-[(E)-3-(4-nitrophenyl)acryloyl]-2-phenethyl-thiazolidine-4-carboxylic acid isopropyl ester Formula: C24H26N2O5S MolecularWeight: 454.53864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1CSC(N1C(=O)C=CC2=CC=C(C=C2)[N+](=O)[O-])CCC3=CC=CC=C3

Isomeric SMILES

CC(C)OC(=O)C1CSC(N1C(=O)/C=C/C2=CC=C(C=C2)[N+](=O)[O-])CCC3=CC=CC=C3

InChI

InChI=1S/C24H26N2O5S/c1-17(2)31-24(28)21-16-32-23(15-11-18-6-4-3-5-7-18)25(21)22(27)14-10-19-8-12-20(13-9-19)26(29)30/h3-10,12-14,17,21,23H,11,15-16H2,1-2H3/b14-10+