2-(5-nitro-1,3-thiazol-2-yl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: 2-(5-nitro-1,3-thiazol-2-yl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: 2-(5-nitrothiazol-2-yl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(5-nitro-2-thiazolyl)-1,3-dioxo-5-isoindolecarboxylate IUPAC Name: 2-(5-nitro-1,3-thiazol-2-yl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 1,3-diketo-2-(5-nitrothiazol-2-yl)isoindoline-5-carboxylate Formula: C12H4N3O6S- MolecularWeight: 318.24166

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)[O-])C(=O)N(C2=O)C3=NC=C(S3)[N+](=O)[O-]

Isomeric SMILES

C1=CC2=C(C=C1C(=O)[O-])C(=O)N(C2=O)C3=NC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C12H5N3O6S/c16-9-6-2-1-5(11(18)19)3-7(6)10(17)14(9)12-13-4-8(22-12)15(20)21/h1-4H,(H,18,19)/p-1