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(6-nitro-4H-1,3-benzodioxin-8-yl)methyl (E)-3-[4-(cyanomethoxy)phenyl]prop-2-enoate

(6-nitro-4H-1,3-benzodioxin-8-yl)methyl (E)-3-[4-(cyanomethoxy)phenyl]prop-2-enoate

Systemtic Name:(6-nitro-4H-1,3-benzodioxin-8-yl)methyl (E)-3-[4-(cyanomethoxy)phenyl]prop-2-enoate
Openeye Name:(6-nitro-4H-1,3-benzodioxin-8-yl)methyl (E)-3-[4-(cyanomethoxy)phenyl]prop-2-enoate
CAS Name:(E)-3-[4-(cyanomethoxy)phenyl]-2-propenoic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester
IUPAC Name:(6-nitro-4H-1,3-benzodioxin-8-yl)methyl (E)-3-[4-(cyanomethoxy)phenyl]prop-2-enoate
Traditional Name:(E)-3-[4-(cyanomethoxy)phenyl]acrylic acid (6-nitro-4H-1,3-benzodioxin-8-yl)methyl ester
Formula: C20H16N2O7
MolecularWeight: 396.35024
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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)COC(=O)C=CC3=CC=C(C=C3)OCC#N)[N+](=O)[O-]


Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)COC(=O)/C=C/C3=CC=C(C=C3)OCC#N)[N+](=O)[O-]


InChI

InChI=1S/C20H16N2O7/c21-7-8-27-18-4-1-14(2-5-18)3-6-19(23)28-12-16-10-17(22(24)25)9-15-11-26-13-29-20(15)16/h1-6,9-10H,8,11-13H2/b6-3+


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