(5-chloranyl-1,2,3-thiadiazol-4-yl)methyl 4-(4-chloranyl-2-nitro-phenoxy)-3-methoxy-benzoate

Systemtic Name: (5-chloranyl-1,2,3-thiadiazol-4-yl)methyl 4-(4-chloranyl-2-nitro-phenoxy)-3-methoxy-benzoate Openeye Name: (5-chlorothiadiazol-4-yl)methyl 4-(4-chloro-2-nitro-phenoxy)-3-methoxy-benzoate CAS Name: 4-(4-chloro-2-nitrophenoxy)-3-methoxybenzoic acid (5-chloro-4-thiadiazolyl)methyl ester IUPAC Name: (5-chlorothiadiazol-4-yl)methyl 4-(4-chloro-2-nitrophenoxy)-3-methoxybenzoate Traditional Name: 4-(4-chloro-2-nitro-phenoxy)-3-methoxy-benzoic acid (5-chlorothiadiazol-4-yl)methyl ester Formula: C17H11Cl2N3O6S MolecularWeight: 456.25674

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OCC2=C(SN=N2)Cl)OC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OCC2=C(SN=N2)Cl)OC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H11Cl2N3O6S/c1-26-15-6-9(17(23)27-8-11-16(19)29-21-20-11)2-4-14(15)28-13-5-3-10(18)7-12(13)22(24)25/h2-7H,8H2,1H3