[5-(1,3-benzodioxol-5-yl)-4-nitro-pent-4-enyl] ethanoate

Systemtic Name: [5-(1,3-benzodioxol-5-yl)-4-nitro-pent-4-enyl] ethanoate Openeye Name: [5-(1,3-benzodioxol-5-yl)-4-nitro-pent-4-enyl] acetate CAS Name: acetic acid [5-(1,3-benzodioxol-5-yl)-4-nitropent-4-enyl] ester IUPAC Name: [5-(1,3-benzodioxol-5-yl)-4-nitropent-4-enyl] acetate Traditional Name: acetic acid [5-(1,3-benzodioxol-5-yl)-4-nitro-pent-4-enyl] ester Formula: C14H15NO6 MolecularWeight: 293.272

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCCC(=CC1=CC2=C(C=C1)OCO2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)OCCCC(=CC1=CC2=C(C=C1)OCO2)[N+](=O)[O-]

InChI

InChI=1S/C14H15NO6/c1-10(16)19-6-2-3-12(15(17)18)7-11-4-5-13-14(8-11)21-9-20-13/h4-5,7-8H,2-3,6,9H2,1H3