2-[2,4-bis(chloranyl)-6-methyl-phenoxy]-N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-[2,4-bis(chloranyl)-6-methyl-phenoxy]-N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-(2,4-dichloro-6-methyl-phenoxy)-N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-(2,4-dichloro-6-methylphenoxy)-N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-(2,4-dichloro-6-methylphenoxy)-N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-(2,4-dichloro-6-methyl-phenoxy)-N-(4-methoxy-6-nitro-1,3-benzothiazol-2-yl)acetamide Formula: C17H13Cl2N3O5S MolecularWeight: 442.27322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)NC2=NC3=C(C=C(C=C3S2)[N+](=O)[O-])OC)Cl)Cl

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)NC2=NC3=C(C=C(C=C3S2)[N+](=O)[O-])OC)Cl)Cl

InChI

InChI=1S/C17H13Cl2N3O5S/c1-8-3-9(18)4-11(19)16(8)27-7-14(23)20-17-21-15-12(26-2)5-10(22(24)25)6-13(15)28-17/h3-6H,7H2,1-2H3,(H,20,21,23)