4-[(2S)-3-(furan-2-ylmethyl)-4-oxidanylidene-1,3-thiazolidin-2-yl]-2-methoxy-6-nitro-phenolate

Systemtic Name: 4-[(2S)-3-(furan-2-ylmethyl)-4-oxidanylidene-1,3-thiazolidin-2-yl]-2-methoxy-6-nitro-phenolate Openeye Name: 4-[(2S)-3-(2-furylmethyl)-4-oxo-thiazolidin-2-yl]-2-methoxy-6-nitro-phenolate CAS Name: 4-[(2S)-3-(2-furanylmethyl)-4-oxo-2-thiazolidinyl]-2-methoxy-6-nitrophenolate IUPAC Name: 4-[(2S)-3-(furan-2-ylmethyl)-4-oxo-1,3-thiazolidin-2-yl]-2-methoxy-6-nitrophenolate Traditional Name: 4-[(2S)-3-(2-furfuryl)-4-keto-thiazolidin-2-yl]-2-methoxy-6-nitro-phenolate Formula: C15H13N2O6S- MolecularWeight: 349.33852

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1[O-])[N+](=O)[O-])C2N(C(=O)CS2)CC3=CC=CO3

Isomeric SMILES

COC1=CC(=CC(=C1[O-])[N+](=O)[O-])[C@H]2N(C(=O)CS2)CC3=CC=CO3

InChI

InChI=1S/C15H14N2O6S/c1-22-12-6-9(5-11(14(12)19)17(20)21)15-16(13(18)8-24-15)7-10-3-2-4-23-10/h2-6,15,19H,7-8H2,1H3/p-1/t15-/m0/s1