2-[4-nitro-2-[(Z)-(4-oxidanylidene-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-nitro-2-[(Z)-(4-oxidanylidene-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy]ethanoic acid Openeye Name: 2-[4-nitro-2-[(Z)-(4-oxo-3-phenyl-2-thioxo-thiazolidin-5-ylidene)methyl]phenoxy]acetic acid CAS Name: 2-[4-nitro-2-[(Z)-(4-oxo-3-phenyl-2-sulfanylidene-5-thiazolidinylidene)methyl]phenoxy]acetic acid IUPAC Name: 2-[4-nitro-2-[(Z)-(4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]phenoxy]acetic acid Traditional Name: 2-[2-[(Z)-(4-keto-3-phenyl-2-thioxo-thiazolidin-5-ylidene)methyl]-4-nitro-phenoxy]acetic acid Formula: C18H12N2O6S2 MolecularWeight: 416.42768

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(=CC3=C(C=CC(=C3)[N+](=O)[O-])OCC(=O)O)SC2=S

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)/C(=C/C3=C(C=CC(=C3)[N+](=O)[O-])OCC(=O)O)/SC2=S

InChI

InChI=1S/C18H12N2O6S2/c21-16(22)10-26-14-7-6-13(20(24)25)8-11(14)9-15-17(23)19(18(27)28-15)12-4-2-1-3-5-12/h1-9H,10H2,(H,21,22)/b15-9-