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

Systemtic Name: 4-[2,4-bis(chloranyl)phenoxy]-N-(6-nitro-1,3-benzothiazol-2-yl)butanamide Openeye Name: 4-(2,4-dichlorophenoxy)-N-(6-nitro-1,3-benzothiazol-2-yl)butanamide CAS Name: 4-(2,4-dichlorophenoxy)-N-(6-nitro-1,3-benzothiazol-2-yl)butanamide IUPAC Name: 4-(2,4-dichlorophenoxy)-N-(6-nitro-1,3-benzothiazol-2-yl)butanamide Traditional Name: 4-(2,4-dichlorophenoxy)-N-(6-nitro-1,3-benzothiazol-2-yl)butyramide Formula: C17H13Cl2N3O4S MolecularWeight: 426.27382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])SC(=N2)NC(=O)CCCOC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])SC(=N2)NC(=O)CCCOC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H13Cl2N3O4S/c18-10-3-6-14(12(19)8-10)26-7-1-2-16(23)21-17-20-13-5-4-11(22(24)25)9-15(13)27-17/h3-6,8-9H,1-2,7H2,(H,20,21,23)