(2S,4S)-2-[5-(2-nitrophenyl)furan-2-yl]-1,3-thiazolidin-3-ium-4-carboxylate

Systemtic Name: (2S,4S)-2-[5-(2-nitrophenyl)furan-2-yl]-1,3-thiazolidin-3-ium-4-carboxylate Openeye Name: (2S,4S)-2-[5-(2-nitrophenyl)-2-furyl]thiazolidin-3-ium-4-carboxylate CAS Name: (2S,4S)-2-[5-(2-nitrophenyl)-2-furanyl]-4-thiazolidin-3-iumcarboxylate IUPAC Name: (2S,4S)-2-[5-(2-nitrophenyl)furan-2-yl]-1,3-thiazolidin-3-ium-4-carboxylate Traditional Name: (2S,4S)-2-[5-(2-nitrophenyl)-2-furyl]thiazolidin-3-ium-4-carboxylate Formula: C14H12N2O5S MolecularWeight: 320.32048

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Descriptors Computed from Structure

Canonical SMILES:

C1C([NH2+]C(S1)C2=CC=C(O2)C3=CC=CC=C3[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

C1[C@@H]([NH2+][C@@H](S1)C2=CC=C(O2)C3=CC=CC=C3[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C14H12N2O5S/c17-14(18)9-7-22-13(15-9)12-6-5-11(21-12)8-3-1-2-4-10(8)16(19)20/h1-6,9,13,15H,7H2,(H,17,18)/t9-,13+/m1/s1