3-(1,3-benzodioxol-5-yl)-1-methoxy-2-nitro-prop-1-en-1-ol

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-1-methoxy-2-nitro-prop-1-en-1-ol Openeye Name: 3-(1,3-benzodioxol-5-yl)-1-methoxy-2-nitro-prop-1-en-1-ol CAS Name: 3-(1,3-benzodioxol-5-yl)-1-methoxy-2-nitro-1-propen-1-ol IUPAC Name: 3-(1,3-benzodioxol-5-yl)-1-methoxy-2-nitroprop-1-en-1-ol Traditional Name: 3-(1,3-benzodioxol-5-yl)-1-methoxy-2-nitro-prop-1-en-1-ol Formula: C11H11NO6 MolecularWeight: 253.20814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H11NO6/c1-16-11(13)8(12(14)15)4-7-2-3-9-10(5-7)18-6-17-9/h2-3,5,13H,4,6H2,1H3