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

Systemtic Name: 3-[2-(4-ethoxyphenyl)-1,3-thiazol-4-yl]-6-nitro-2-oxidanylidene-chromen-7-olate Openeye Name: 3-[2-(4-ethoxyphenyl)thiazol-4-yl]-6-nitro-2-oxo-chromen-7-olate CAS Name: 3-[2-(4-ethoxyphenyl)-4-thiazolyl]-6-nitro-2-oxo-1-benzopyran-7-olate IUPAC Name: 3-[2-(4-ethoxyphenyl)-1,3-thiazol-4-yl]-6-nitro-2-oxochromen-7-olate Traditional Name: 2-keto-6-nitro-3-(2-p-phenetylthiazol-4-yl)chromen-7-olate Formula: C20H13N2O6S- MolecularWeight: 409.39202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC(=CS2)C3=CC4=CC(=C(C=C4OC3=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC(=CS2)C3=CC4=CC(=C(C=C4OC3=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H14N2O6S/c1-2-27-13-5-3-11(4-6-13)19-21-15(10-29-19)14-7-12-8-16(22(25)26)17(23)9-18(12)28-20(14)24/h3-10,23H,2H2,1H3/p-1