N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-3,5-dinitro-benzamide

Systemtic Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-3,5-dinitro-benzamide Openeye Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-3,5-dinitro-benzamide CAS Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-3,5-dinitrobenzamide IUPAC Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-3,5-dinitrobenzamide Traditional Name: N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-3,5-dinitro-benzamide Formula: C15H9N5O8S MolecularWeight: 419.32566

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1)[N+](=O)[O-])SC(=N2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=C2C(=CC(=C1)[N+](=O)[O-])SC(=N2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H9N5O8S/c1-28-11-5-10(20(26)27)6-12-13(11)16-15(29-12)17-14(21)7-2-8(18(22)23)4-9(3-7)19(24)25/h2-6H,1H3,(H,16,17,21)