N-[2-(3,4-diethoxyphenyl)ethyl]-6-nitro-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-(3,4-diethoxyphenyl)ethyl]-6-nitro-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-(3,4-diethoxyphenyl)ethyl]-6-nitro-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-(3,4-diethoxyphenyl)ethyl]-6-nitro-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-(3,4-diethoxyphenyl)ethyl]-6-nitro-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-(3,4-diethoxyphenyl)ethyl]-6-nitro-piperonylamide Formula: C20H22N2O7 MolecularWeight: 402.39788

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCO3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCO3)OCC

InChI

InChI=1S/C20H22N2O7/c1-3-26-16-6-5-13(9-17(16)27-4-2)7-8-21-20(23)14-10-18-19(29-12-28-18)11-15(14)22(24)25/h5-6,9-11H,3-4,7-8,12H2,1-2H3,(H,21,23)