N-(1,3-benzothiazol-2-yl)-3,5-dinitro-benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-3,5-dinitro-benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-3,5-dinitro-benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-3,5-dinitrobenzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-3,5-dinitrobenzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-3,5-dinitro-benzamide Formula: C14H8N4O5S MolecularWeight: 344.30212

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H8N4O5S/c19-13(16-14-15-11-3-1-2-4-12(11)24-14)8-5-9(17(20)21)7-10(6-8)18(22)23/h1-7H,(H,15,16,19)