2-(4-ethoxyphenoxy)ethyl 6-nitro-1,3-benzodioxole-5-carboxylate

Systemtic Name: 2-(4-ethoxyphenoxy)ethyl 6-nitro-1,3-benzodioxole-5-carboxylate Openeye Name: 2-(4-ethoxyphenoxy)ethyl 6-nitro-1,3-benzodioxole-5-carboxylate CAS Name: 6-nitro-1,3-benzodioxole-5-carboxylic acid 2-(4-ethoxyphenoxy)ethyl ester IUPAC Name: 2-(4-ethoxyphenoxy)ethyl 6-nitro-1,3-benzodioxole-5-carboxylate Traditional Name: 6-nitro-piperonylic acid 2-(4-ethoxyphenoxy)ethyl ester Formula: C18H17NO8 MolecularWeight: 375.32948

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCCOC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCO3

Isomeric SMILES

CCOC1=CC=C(C=C1)OCCOC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCO3

InChI

InChI=1S/C18H17NO8/c1-2-23-12-3-5-13(6-4-12)24-7-8-25-18(20)14-9-16-17(27-11-26-16)10-15(14)19(21)22/h3-6,9-10H,2,7-8,11H2,1H3