methyl 4-(3-methoxyphenoxy)-3-nitro-5-prop-2-enoxy-benzoate

Systemtic Name: methyl 4-(3-methoxyphenoxy)-3-nitro-5-prop-2-enoxy-benzoate Openeye Name: methyl 3-allyloxy-4-(3-methoxyphenoxy)-5-nitro-benzoate CAS Name: 4-(3-methoxyphenoxy)-3-nitro-5-prop-2-enoxybenzoic acid methyl ester IUPAC Name: methyl 4-(3-methoxyphenoxy)-3-nitro-5-prop-2-enoxybenzoate Traditional Name: 3-allyloxy-4-(3-methoxyphenoxy)-5-nitro-benzoic acid methyl ester Formula: C18H17NO7 MolecularWeight: 359.33008

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)OC2=C(C=C(C=C2OCC=C)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)OC2=C(C=C(C=C2OCC=C)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H17NO7/c1-4-8-25-16-10-12(18(20)24-3)9-15(19(21)22)17(16)26-14-7-5-6-13(11-14)23-2/h4-7,9-11H,1,8H2,2-3H3