methyl 4-(2-chloranyl-5-methoxy-phenoxy)-3-nitro-5-[2-(oxan-2-yloxy)ethoxy]benzoate

Systemtic Name: methyl 4-(2-chloranyl-5-methoxy-phenoxy)-3-nitro-5-[2-(oxan-2-yloxy)ethoxy]benzoate Openeye Name: methyl 4-(2-chloro-5-methoxy-phenoxy)-3-nitro-5-(2-tetrahydropyran-2-yloxyethoxy)benzoate CAS Name: 4-(2-chloro-5-methoxyphenoxy)-3-nitro-5-[2-(2-oxanyloxy)ethoxy]benzoic acid methyl ester IUPAC Name: methyl 4-(2-chloro-5-methoxyphenoxy)-3-nitro-5-[2-(oxan-2-yloxy)ethoxy]benzoate Traditional Name: 4-(2-chloro-5-methoxy-phenoxy)-3-nitro-5-(2-tetrahydropyran-2-yloxyethoxy)benzoic acid methyl ester Formula: C22H24ClNO9 MolecularWeight: 481.88026

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Cl)OC2=C(C=C(C=C2OCCOC3CCCCO3)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)Cl)OC2=C(C=C(C=C2OCCOC3CCCCO3)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H24ClNO9/c1-28-15-6-7-16(23)18(13-15)33-21-17(24(26)27)11-14(22(25)29-2)12-19(21)30-9-10-32-20-5-3-4-8-31-20/h6-7,11-13,20H,3-5,8-10H2,1-2H3