methyl 4-(2-chloranyl-4-methoxy-phenoxy)-3,5-dinitro-benzoate

Systemtic Name: methyl 4-(2-chloranyl-4-methoxy-phenoxy)-3,5-dinitro-benzoate Openeye Name: methyl 4-(2-chloro-4-methoxy-phenoxy)-3,5-dinitro-benzoate CAS Name: 4-(2-chloro-4-methoxyphenoxy)-3,5-dinitrobenzoic acid methyl ester IUPAC Name: methyl 4-(2-chloro-4-methoxyphenoxy)-3,5-dinitrobenzoate Traditional Name: 4-(2-chloro-4-methoxy-phenoxy)-3,5-dinitro-benzoic acid methyl ester Formula: C15H11ClN2O8 MolecularWeight: 382.70944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC2=C(C=C(C=C2[N+](=O)[O-])C(=O)OC)[N+](=O)[O-])Cl

Isomeric SMILES

COC1=CC(=C(C=C1)OC2=C(C=C(C=C2[N+](=O)[O-])C(=O)OC)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H11ClN2O8/c1-24-9-3-4-13(10(16)7-9)26-14-11(17(20)21)5-8(15(19)25-2)6-12(14)18(22)23/h3-7H,1-2H3