2-(2-bromanyl-4-chloranyl-3,5-dimethyl-phenoxy)-N-(6-nitro-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-(2-bromanyl-4-chloranyl-3,5-dimethyl-phenoxy)-N-(6-nitro-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-(2-bromo-4-chloro-3,5-dimethyl-phenoxy)-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-(2-bromo-4-chloro-3,5-dimethylphenoxy)-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-(2-bromo-4-chloro-3,5-dimethylphenoxy)-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-(2-bromo-4-chloro-3,5-dimethyl-phenoxy)-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide Formula: C17H13BrClN3O4S MolecularWeight: 470.72482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1Cl)C)Br)OCC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C(=C1Cl)C)Br)OCC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H13BrClN3O4S/c1-8-5-12(15(18)9(2)16(8)19)26-7-14(23)21-17-20-11-4-3-10(22(24)25)6-13(11)27-17/h3-6H,7H2,1-2H3,(H,20,21,23)