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

Systemtic Name: 2-chloranyl-N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-5-nitro-benzamide Openeye Name: 2-chloro-N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-5-nitro-benzamide CAS Name: 2-chloro-N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-5-nitrobenzamide IUPAC Name: 2-chloro-N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-5-nitrobenzamide Traditional Name: 2-chloro-N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-5-nitro-benzamide Formula: C15H9ClN4O6S MolecularWeight: 408.77316

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H9ClN4O6S/c1-26-11-5-8(20(24)25)6-12-13(11)17-15(27-12)18-14(21)9-4-7(19(22)23)2-3-10(9)16/h2-6H,1H3,(H,17,18,21)