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1,3-benzodioxol-5-ylmethyl 4,5-dimethoxy-2-nitro-benzoate

1,3-benzodioxol-5-ylmethyl 4,5-dimethoxy-2-nitro-benzoate

Systemtic Name:1,3-benzodioxol-5-ylmethyl 4,5-dimethoxy-2-nitro-benzoate
Openeye Name:1,3-benzodioxol-5-ylmethyl 4,5-dimethoxy-2-nitro-benzoate
CAS Name:4,5-dimethoxy-2-nitrobenzoic acid 1,3-benzodioxol-5-ylmethyl ester
IUPAC Name:1,3-benzodioxol-5-ylmethyl 4,5-dimethoxy-2-nitrobenzoate
Traditional Name:4,5-dimethoxy-2-nitro-benzoic acid piperonyl ester
Formula: C17H15NO8
MolecularWeight: 361.3029
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OCC2=CC3=C(C=C2)OCO3)[N+](=O)[O-])OC


Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OCC2=CC3=C(C=C2)OCO3)[N+](=O)[O-])OC


InChI

InChI=1S/C17H15NO8/c1-22-14-6-11(12(18(20)21)7-15(14)23-2)17(19)24-8-10-3-4-13-16(5-10)26-9-25-13/h3-7H,8-9H2,1-2H3


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