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

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-4,5-dimethoxy-2-nitro-benzamide Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)-4,5-dimethoxy-2-nitro-benzamide CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-4,5-dimethoxy-2-nitrobenzamide IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-4,5-dimethoxy-2-nitrobenzamide Traditional Name: N-(6-chloro-1,3-benzothiazol-2-yl)-4,5-dimethoxy-2-nitro-benzamide Formula: C16H12ClN3O5S MolecularWeight: 393.80158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)Cl)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)Cl)[N+](=O)[O-])OC

InChI

InChI=1S/C16H12ClN3O5S/c1-24-12-6-9(11(20(22)23)7-13(12)25-2)15(21)19-16-18-10-4-3-8(17)5-14(10)26-16/h3-7H,1-2H3,(H,18,19,21)