(4-methoxycarbonylphenyl)methyl 6-nitro-1,3-benzodioxole-5-carboxylate

Systemtic Name: (4-methoxycarbonylphenyl)methyl 6-nitro-1,3-benzodioxole-5-carboxylate Openeye Name: (4-methoxycarbonylphenyl)methyl 6-nitro-1,3-benzodioxole-5-carboxylate CAS Name: 6-nitro-1,3-benzodioxole-5-carboxylic acid (4-methoxycarbonylphenyl)methyl ester IUPAC Name: (4-methoxycarbonylphenyl)methyl 6-nitro-1,3-benzodioxole-5-carboxylate Traditional Name: 6-nitro-piperonylic acid (4-carbomethoxybenzyl) ester Formula: C17H13NO8 MolecularWeight: 359.28702

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)COC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCO3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)COC(=O)C2=CC3=C(C=C2[N+](=O)[O-])OCO3

InChI

InChI=1S/C17H13NO8/c1-23-16(19)11-4-2-10(3-5-11)8-24-17(20)12-6-14-15(26-9-25-14)7-13(12)18(21)22/h2-7H,8-9H2,1H3