5-[(E)-2-(4-methoxyphenyl)ethenyl]-6-nitro-1,3-benzodioxole

Systemtic Name: 5-[(E)-2-(4-methoxyphenyl)ethenyl]-6-nitro-1,3-benzodioxole Openeye Name: 5-[(E)-2-(4-methoxyphenyl)vinyl]-6-nitro-1,3-benzodioxole CAS Name: 5-[(E)-2-(4-methoxyphenyl)ethenyl]-6-nitro-1,3-benzodioxole IUPAC Name: 5-[(E)-2-(4-methoxyphenyl)ethenyl]-6-nitro-1,3-benzodioxole Traditional Name: 5-[(E)-2-(4-methoxyphenyl)vinyl]-6-nitro-1,3-benzodioxole Formula: C16H13NO5 MolecularWeight: 299.27812

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC2=CC3=C(C=C2[N+](=O)[O-])OCO3

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C2=CC3=C(C=C2[N+](=O)[O-])OCO3

InChI

InChI=1S/C16H13NO5/c1-20-13-6-3-11(4-7-13)2-5-12-8-15-16(22-10-21-15)9-14(12)17(18)19/h2-9H,10H2,1H3/b5-2+