methyl 2-[(4-nitro-1,3-benzodioxol-5-yl)-oxidanyl-methyl]prop-2-enoate

Systemtic Name: methyl 2-[(4-nitro-1,3-benzodioxol-5-yl)-oxidanyl-methyl]prop-2-enoate Openeye Name: methyl 2-[hydroxy-(4-nitro-1,3-benzodioxol-5-yl)methyl]prop-2-enoate CAS Name: 2-[hydroxy-(4-nitro-1,3-benzodioxol-5-yl)methyl]-2-propenoic acid methyl ester IUPAC Name: methyl 2-[hydroxy-(4-nitro-1,3-benzodioxol-5-yl)methyl]prop-2-enoate Traditional Name: 2-[hydroxy-(4-nitro-1,3-benzodioxol-5-yl)methyl]acrylic acid methyl ester Formula: C12H11NO7 MolecularWeight: 281.21824

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=C)C(C1=C(C2=C(C=C1)OCO2)[N+](=O)[O-])O

Isomeric SMILES

COC(=O)C(=C)C(C1=C(C2=C(C=C1)OCO2)[N+](=O)[O-])O

InChI

InChI=1S/C12H11NO7/c1-6(12(15)18-2)10(14)7-3-4-8-11(20-5-19-8)9(7)13(16)17/h3-4,10,14H,1,5H2,2H3