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quinolin-8-ylmethyl 6-nitro-1,3-benzodioxole-5-carboxylate

quinolin-8-ylmethyl 6-nitro-1,3-benzodioxole-5-carboxylate

Systemtic Name:quinolin-8-ylmethyl 6-nitro-1,3-benzodioxole-5-carboxylate
Openeye Name:8-quinolylmethyl 6-nitro-1,3-benzodioxole-5-carboxylate
CAS Name:6-nitro-1,3-benzodioxole-5-carboxylic acid 8-quinolinylmethyl ester
IUPAC Name:quinolin-8-ylmethyl 6-nitro-1,3-benzodioxole-5-carboxylate
Traditional Name:6-nitro-piperonylic acid 8-quinolylmethyl ester
Formula: C18H12N2O6
MolecularWeight: 352.29768
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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C(=O)OCC3=CC=CC4=C3N=CC=C4)[N+](=O)[O-]


Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)C(=O)OCC3=CC=CC4=C3N=CC=C4)[N+](=O)[O-]


InChI

InChI=1S/C18H12N2O6/c21-18(13-7-15-16(26-10-25-15)8-14(13)20(22)23)24-9-12-4-1-3-11-5-2-6-19-17(11)12/h1-8H,9-10H2


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