4-[(2R)-2-(4-methoxy-3-nitro-phenyl)-1,3-thiazolidin-3-yl]-4-oxidanylidene-butanoate

Systemtic Name: 4-[(2R)-2-(4-methoxy-3-nitro-phenyl)-1,3-thiazolidin-3-yl]-4-oxidanylidene-butanoate Openeye Name: 4-[(2R)-2-(4-methoxy-3-nitro-phenyl)thiazolidin-3-yl]-4-oxo-butanoate CAS Name: 4-[(2R)-2-(4-methoxy-3-nitrophenyl)-3-thiazolidinyl]-4-oxobutanoate IUPAC Name: 4-[(2R)-2-(4-methoxy-3-nitrophenyl)-1,3-thiazolidin-3-yl]-4-oxobutanoate Traditional Name: 4-keto-4-[(2R)-2-(4-methoxy-3-nitro-phenyl)thiazolidin-3-yl]butyrate Formula: C14H15N2O6S- MolecularWeight: 339.3437

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2N(CCS2)C(=O)CCC(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)[C@@H]2N(CCS2)C(=O)CCC(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H16N2O6S/c1-22-11-3-2-9(8-10(11)16(20)21)14-15(6-7-23-14)12(17)4-5-13(18)19/h2-3,8,14H,4-7H2,1H3,(H,18,19)/p-1/t14-/m1/s1