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1,3-benzodioxol-5-ylmethyl 2-(2-methoxyethylamino)-5-nitro-benzoate

1,3-benzodioxol-5-ylmethyl 2-(2-methoxyethylamino)-5-nitro-benzoate

Systemtic Name:1,3-benzodioxol-5-ylmethyl 2-(2-methoxyethylamino)-5-nitro-benzoate
Openeye Name:1,3-benzodioxol-5-ylmethyl 2-(2-methoxyethylamino)-5-nitro-benzoate
CAS Name:2-(2-methoxyethylamino)-5-nitrobenzoic acid 1,3-benzodioxol-5-ylmethyl ester
IUPAC Name:1,3-benzodioxol-5-ylmethyl 2-(2-methoxyethylamino)-5-nitrobenzoate
Traditional Name:2-(2-methoxyethylamino)-5-nitro-benzoic acid piperonyl ester
Formula: C18H18N2O7
MolecularWeight: 374.34472
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Descriptors Computed from Structure

Canonical SMILES:

COCCNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC2=CC3=C(C=C2)OCO3


Isomeric SMILES

COCCNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC2=CC3=C(C=C2)OCO3


InChI

InChI=1S/C18H18N2O7/c1-24-7-6-19-15-4-3-13(20(22)23)9-14(15)18(21)25-10-12-2-5-16-17(8-12)27-11-26-16/h2-5,8-9,19H,6-7,10-11H2,1H3


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