methyl 6-(2-nitrophenyl)-1,3-benzodioxole-5-carboxylate

Systemtic Name: methyl 6-(2-nitrophenyl)-1,3-benzodioxole-5-carboxylate Openeye Name: methyl 6-(2-nitrophenyl)-1,3-benzodioxole-5-carboxylate CAS Name: 6-(2-nitrophenyl)-1,3-benzodioxole-5-carboxylic acid methyl ester IUPAC Name: methyl 6-(2-nitrophenyl)-1,3-benzodioxole-5-carboxylate Traditional Name: 6-(2-nitrophenyl)-piperonylic acid methyl ester Formula: C15H11NO6 MolecularWeight: 301.25094

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1C3=CC=CC=C3[N+](=O)[O-])OCO2

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1C3=CC=CC=C3[N+](=O)[O-])OCO2

InChI

InChI=1S/C15H11NO6/c1-20-15(17)11-7-14-13(21-8-22-14)6-10(11)9-4-2-3-5-12(9)16(18)19/h2-7H,8H2,1H3