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

Systemtic Name: 2-(4-propoxyphenoxy)ethyl 6-nitro-1,3-benzodioxole-5-carboxylate Openeye Name: 2-(4-propoxyphenoxy)ethyl 6-nitro-1,3-benzodioxole-5-carboxylate CAS Name: 6-nitro-1,3-benzodioxole-5-carboxylic acid 2-(4-propoxyphenoxy)ethyl ester IUPAC Name: 2-(4-propoxyphenoxy)ethyl 6-nitro-1,3-benzodioxole-5-carboxylate Traditional Name: 6-nitro-piperonylic acid 2-(4-propoxyphenoxy)ethyl ester Formula: C19H19NO8 MolecularWeight: 389.35606

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)OCCOC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCO3

Isomeric SMILES

CCCOC1=CC=C(C=C1)OCCOC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCO3

InChI

InChI=1S/C19H19NO8/c1-2-7-24-13-3-5-14(6-4-13)25-8-9-26-19(21)15-10-17-18(28-12-27-17)11-16(15)20(22)23/h3-6,10-11H,2,7-9,12H2,1H3