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

Systemtic Name: 4-(4-chloranyl-2-nitro-phenoxy)-N-(6-fluoranyl-1,3-benzothiazol-2-yl)-3-methoxy-benzamide Openeye Name: 4-(4-chloro-2-nitro-phenoxy)-N-(6-fluoro-1,3-benzothiazol-2-yl)-3-methoxy-benzamide CAS Name: 4-(4-chloro-2-nitrophenoxy)-N-(6-fluoro-1,3-benzothiazol-2-yl)-3-methoxybenzamide IUPAC Name: 4-(4-chloro-2-nitrophenoxy)-N-(6-fluoro-1,3-benzothiazol-2-yl)-3-methoxybenzamide Traditional Name: 4-(4-chloro-2-nitro-phenoxy)-N-(6-fluoro-1,3-benzothiazol-2-yl)-3-methoxy-benzamide Formula: C21H13ClFN3O5S MolecularWeight: 473.861423

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)F)OC4=C(C=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)F)OC4=C(C=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H13ClFN3O5S/c1-30-18-8-11(20(27)25-21-24-14-5-4-13(23)10-19(14)32-21)2-6-17(18)31-16-7-3-12(22)9-15(16)26(28)29/h2-10H,1H3,(H,24,25,27)