3-(2-methyl-6-nitro-phenyl)carbonyl-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 3-(2-methyl-6-nitro-phenyl)carbonyl-1,3-thiazolidine-4-carboxylic acid Openeye Name: 3-(2-methyl-6-nitro-benzoyl)thiazolidine-4-carboxylic acid CAS Name: 3-[(2-methyl-6-nitrophenyl)-oxomethyl]-4-thiazolidinecarboxylic acid IUPAC Name: 3-(2-methyl-6-nitrobenzoyl)-1,3-thiazolidine-4-carboxylic acid Traditional Name: 3-(2-methyl-6-nitro-benzoyl)thiazolidine-4-carboxylic acid Formula: C12H12N2O5S MolecularWeight: 296.29908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)[N+](=O)[O-])C(=O)N2CSCC2C(=O)O

Isomeric SMILES

CC1=C(C(=CC=C1)[N+](=O)[O-])C(=O)N2CSCC2C(=O)O

InChI

InChI=1S/C12H12N2O5S/c1-7-3-2-4-8(14(18)19)10(7)11(15)13-6-20-5-9(13)12(16)17/h2-4,9H,5-6H2,1H3,(H,16,17)