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

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

Systemtic Name:2-(5-nitro-1,3-thiazol-2-yl)-1,3-bis(oxidanylidene)isoindole-5-carboxylic acid
Openeye Name:2-(5-nitrothiazol-2-yl)-1,3-dioxo-isoindoline-5-carboxylic acid
CAS Name:2-(5-nitro-2-thiazolyl)-1,3-dioxo-5-isoindolecarboxylic acid
IUPAC Name:2-(5-nitro-1,3-thiazol-2-yl)-1,3-dioxoisoindole-5-carboxylic acid
Traditional Name:1,3-diketo-2-(5-nitrothiazol-2-yl)isoindoline-5-carboxylic acid
Formula: C12H5N3O6S
MolecularWeight: 319.2496
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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)


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