3-[2-(2,4-dimethylphenyl)-1,3-thiazol-4-yl]-6-nitro-2-oxidanylidene-chromen-7-olate

Systemtic Name: 3-[2-(2,4-dimethylphenyl)-1,3-thiazol-4-yl]-6-nitro-2-oxidanylidene-chromen-7-olate Openeye Name: 3-[2-(2,4-dimethylphenyl)thiazol-4-yl]-6-nitro-2-oxo-chromen-7-olate CAS Name: 3-[2-(2,4-dimethylphenyl)-4-thiazolyl]-6-nitro-2-oxo-1-benzopyran-7-olate IUPAC Name: 3-[2-(2,4-dimethylphenyl)-1,3-thiazol-4-yl]-6-nitro-2-oxochromen-7-olate Traditional Name: 3-[2-(2,4-dimethylphenyl)thiazol-4-yl]-2-keto-6-nitro-chromen-7-olate Formula: C20H13N2O5S- MolecularWeight: 393.39262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NC(=CS2)C3=CC4=CC(=C(C=C4OC3=O)[O-])[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NC(=CS2)C3=CC4=CC(=C(C=C4OC3=O)[O-])[N+](=O)[O-])C

InChI

InChI=1S/C20H14N2O5S/c1-10-3-4-13(11(2)5-10)19-21-15(9-28-19)14-6-12-7-16(22(25)26)17(23)8-18(12)27-20(14)24/h3-9,23H,1-2H3/p-1