3-[(4,5-dimethoxy-2-nitro-phenyl)methoxycarbonyl]-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 3-[(4,5-dimethoxy-2-nitro-phenyl)methoxycarbonyl]-1,3-thiazolidine-4-carboxylic acid Openeye Name: 3-[(4,5-dimethoxy-2-nitro-phenyl)methoxycarbonyl]thiazolidine-4-carboxylic acid CAS Name: 3-[(4,5-dimethoxy-2-nitrophenyl)methoxy-oxomethyl]-4-thiazolidinecarboxylic acid IUPAC Name: 3-[(4,5-dimethoxy-2-nitrophenyl)methoxycarbonyl]-1,3-thiazolidine-4-carboxylic acid Traditional Name: 3-(4,5-dimethoxy-2-nitro-benzyl)oxycarbonylthiazolidine-4-carboxylic acid Formula: C14H16N2O8S MolecularWeight: 372.35044

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)COC(=O)N2CSCC2C(=O)O)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)COC(=O)N2CSCC2C(=O)O)[N+](=O)[O-])OC

InChI

InChI=1S/C14H16N2O8S/c1-22-11-3-8(9(16(20)21)4-12(11)23-2)5-24-14(19)15-7-25-6-10(15)13(17)18/h3-4,10H,5-7H2,1-2H3,(H,17,18)