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

Systemtic Name: propan-2-yl 3-(4-methyl-3-nitro-phenyl)carbonyl-2-phenethyl-1,3-thiazolidine-4-carboxylate Openeye Name: isopropyl 3-(4-methyl-3-nitro-benzoyl)-2-phenethyl-thiazolidine-4-carboxylate CAS Name: 3-[(4-methyl-3-nitrophenyl)-oxomethyl]-2-phenethyl-4-thiazolidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-(4-methyl-3-nitrobenzoyl)-2-phenethyl-1,3-thiazolidine-4-carboxylate Traditional Name: 3-(4-methyl-3-nitro-benzoyl)-2-phenethyl-thiazolidine-4-carboxylic acid isopropyl ester Formula: C23H26N2O5S MolecularWeight: 442.52794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2C(CSC2CCC3=CC=CC=C3)C(=O)OC(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2C(CSC2CCC3=CC=CC=C3)C(=O)OC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C23H26N2O5S/c1-15(2)30-23(27)20-14-31-21(12-10-17-7-5-4-6-8-17)24(20)22(26)18-11-9-16(3)19(13-18)25(28)29/h4-9,11,13,15,20-21H,10,12,14H2,1-3H3