methyl 3-(1,3-benzodioxol-5-yl)-2-nitro-prop-2-enoate

Systemtic Name: methyl 3-(1,3-benzodioxol-5-yl)-2-nitro-prop-2-enoate Openeye Name: methyl 3-(1,3-benzodioxol-5-yl)-2-nitro-prop-2-enoate CAS Name: 3-(1,3-benzodioxol-5-yl)-2-nitro-2-propenoic acid methyl ester IUPAC Name: methyl 3-(1,3-benzodioxol-5-yl)-2-nitroprop-2-enoate Traditional Name: 3-(1,3-benzodioxol-5-yl)-2-nitro-acrylic acid methyl ester Formula: C11H9NO6 MolecularWeight: 251.19226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H9NO6/c1-16-11(13)8(12(14)15)4-7-2-3-9-10(5-7)18-6-17-9/h2-5H,6H2,1H3