methyl 4-[4-(2,6-dinitrophenoxy)-2,6-dimethoxy-phenoxy]butanoate

Systemtic Name: methyl 4-[4-(2,6-dinitrophenoxy)-2,6-dimethoxy-phenoxy]butanoate Openeye Name: methyl 4-[4-(2,6-dinitrophenoxy)-2,6-dimethoxy-phenoxy]butanoate CAS Name: 4-[4-(2,6-dinitrophenoxy)-2,6-dimethoxyphenoxy]butanoic acid methyl ester IUPAC Name: methyl 4-[4-(2,6-dinitrophenoxy)-2,6-dimethoxyphenoxy]butanoate Traditional Name: 4-[4-(2,6-dinitrophenoxy)-2,6-dimethoxy-phenoxy]butyric acid methyl ester Formula: C19H20N2O10 MolecularWeight: 436.3695

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OCCCC(=O)OC)OC)OC2=C(C=CC=C2[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OCCCC(=O)OC)OC)OC2=C(C=CC=C2[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C19H20N2O10/c1-27-15-10-12(11-16(28-2)19(15)30-9-5-8-17(22)29-3)31-18-13(20(23)24)6-4-7-14(18)21(25)26/h4,6-7,10-11H,5,8-9H2,1-3H3