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

Systemtic Name: phenyl (E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enoate Openeye Name: phenyl (E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enoate CAS Name: (E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-2-propenoic acid phenyl ester IUPAC Name: phenyl (E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enoate Traditional Name: (E)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)acrylic acid phenyl ester Formula: C17H13NO6 MolecularWeight: 327.28822

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C(=CC(=C2)[N+](=O)[O-])C=CC(=O)OC3=CC=CC=C3)OCO1

Isomeric SMILES

C1C2=C(C(=CC(=C2)[N+](=O)[O-])/C=C/C(=O)OC3=CC=CC=C3)OCO1

InChI

InChI=1S/C17H13NO6/c19-16(24-15-4-2-1-3-5-15)7-6-12-8-14(18(20)21)9-13-10-22-11-23-17(12)13/h1-9H,10-11H2/b7-6+