N-(2,1,3-benzothiadiazol-4-yl)-2-(2-methoxy-5-nitro-phenoxy)ethanamide

Systemtic Name: N-(2,1,3-benzothiadiazol-4-yl)-2-(2-methoxy-5-nitro-phenoxy)ethanamide Openeye Name: N-(2,1,3-benzothiadiazol-4-yl)-2-(2-methoxy-5-nitro-phenoxy)acetamide CAS Name: N-(2,1,3-benzothiadiazol-4-yl)-2-(2-methoxy-5-nitrophenoxy)acetamide IUPAC Name: N-(2,1,3-benzothiadiazol-4-yl)-2-(2-methoxy-5-nitrophenoxy)acetamide Traditional Name: 2-(2-methoxy-5-nitro-phenoxy)-N-piazthiol-4-yl-acetamide Formula: C15H12N4O5S MolecularWeight: 360.34458

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])OCC(=O)NC2=CC=CC3=NSN=C32

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])OCC(=O)NC2=CC=CC3=NSN=C32

InChI

InChI=1S/C15H12N4O5S/c1-23-12-6-5-9(19(21)22)7-13(12)24-8-14(20)16-10-3-2-4-11-15(10)18-25-17-11/h2-7H,8H2,1H3,(H,16,20)