ethyl (E)-5-(1,3-benzodioxol-5-yl)-4-nitro-pent-4-enoate

Systemtic Name: ethyl (E)-5-(1,3-benzodioxol-5-yl)-4-nitro-pent-4-enoate Openeye Name: ethyl (E)-5-(1,3-benzodioxol-5-yl)-4-nitro-pent-4-enoate CAS Name: (E)-5-(1,3-benzodioxol-5-yl)-4-nitro-4-pentenoic acid ethyl ester IUPAC Name: ethyl (E)-5-(1,3-benzodioxol-5-yl)-4-nitropent-4-enoate Traditional Name: (E)-5-(1,3-benzodioxol-5-yl)-4-nitro-pent-4-enoic acid ethyl ester Formula: C14H15NO6 MolecularWeight: 293.272

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=CC1=CC2=C(C=C1)OCO2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CC/C(=C\C1=CC2=C(C=C1)OCO2)/[N+](=O)[O-]

InChI

InChI=1S/C14H15NO6/c1-2-19-14(16)6-4-11(15(17)18)7-10-3-5-12-13(8-10)21-9-20-12/h3,5,7-8H,2,4,6,9H2,1H3/b11-7+