[2-methoxy-4-[(E)-2-nitroethenyl]phenyl] 2,3-dihydro-1,4-benzodioxine-3-carboxylate

Systemtic Name: [2-methoxy-4-[(E)-2-nitroethenyl]phenyl] 2,3-dihydro-1,4-benzodioxine-3-carboxylate Openeye Name: [2-methoxy-4-[(E)-2-nitrovinyl]phenyl] 2,3-dihydro-1,4-benzodioxine-3-carboxylate CAS Name: 2,3-dihydro-1,4-benzodioxin-3-carboxylic acid [2-methoxy-4-[(E)-2-nitroethenyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-2-nitroethenyl]phenyl] 2,3-dihydro-1,4-benzodioxine-3-carboxylate Traditional Name: 2,3-dihydro-1,4-benzodioxin-3-carboxylic acid [2-methoxy-4-[(E)-2-nitrovinyl]phenyl] ester Formula: C18H15NO7 MolecularWeight: 357.3142

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C[N+](=O)[O-])OC(=O)C2COC3=CC=CC=C3O2

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/[N+](=O)[O-])OC(=O)C2COC3=CC=CC=C3O2

InChI

InChI=1S/C18H15NO7/c1-23-16-10-12(8-9-19(21)22)6-7-15(16)26-18(20)17-11-24-13-4-2-3-5-14(13)25-17/h2-10,17H,11H2,1H3/b9-8+