[2-methoxy-4-(2-nitroethenyl)phenyl] 1,3-benzodioxole-5-carboxylate

Systemtic Name: [2-methoxy-4-(2-nitroethenyl)phenyl] 1,3-benzodioxole-5-carboxylate Openeye Name: [2-methoxy-4-(2-nitrovinyl)phenyl] 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid [2-methoxy-4-(2-nitroethenyl)phenyl] ester IUPAC Name: [2-methoxy-4-(2-nitroethenyl)phenyl] 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid [2-methoxy-4-(2-nitrovinyl)phenyl] ester Formula: C17H13NO7 MolecularWeight: 343.28762

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H13NO7/c1-22-15-8-11(6-7-18(20)21)2-4-14(15)25-17(19)12-3-5-13-16(9-12)24-10-23-13/h2-9H,10H2,1H3