2-(3-nitrophenyl)-3-(9-oxidanyl-9-oxidanylidene-nonanoyl)-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 2-(3-nitrophenyl)-3-(9-oxidanyl-9-oxidanylidene-nonanoyl)-1,3-thiazolidine-4-carboxylic acid Openeye Name: 3-(9-hydroxy-9-oxo-nonanoyl)-2-(3-nitrophenyl)thiazolidine-4-carboxylic acid CAS Name: 3-(9-hydroxy-1,9-dioxononyl)-2-(3-nitrophenyl)-4-thiazolidinecarboxylic acid IUPAC Name: 3-(9-hydroxy-9-oxononanoyl)-2-(3-nitrophenyl)-1,3-thiazolidine-4-carboxylic acid Traditional Name: 3-(9-hydroxy-9-keto-nonanoyl)-2-(3-nitrophenyl)thiazolidine-4-carboxylic acid Formula: C19H24N2O7S MolecularWeight: 424.46806

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C(S1)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)CCCCCCCC(=O)O)C(=O)O

Isomeric SMILES

C1C(N(C(S1)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)CCCCCCCC(=O)O)C(=O)O

InChI

InChI=1S/C19H24N2O7S/c22-16(9-4-2-1-3-5-10-17(23)24)20-15(19(25)26)12-29-18(20)13-7-6-8-14(11-13)21(27)28/h6-8,11,15,18H,1-5,9-10,12H2,(H,23,24)(H,25,26)