3-[2-(1,3-benzodioxol-5-yl)-7-methoxy-3-nitro-1-benzofuran-5-yl]propan-1-ol

Systemtic Name: 3-[2-(1,3-benzodioxol-5-yl)-7-methoxy-3-nitro-1-benzofuran-5-yl]propan-1-ol Openeye Name: 3-[2-(1,3-benzodioxol-5-yl)-7-methoxy-3-nitro-benzofuran-5-yl]propan-1-ol CAS Name: 3-[2-(1,3-benzodioxol-5-yl)-7-methoxy-3-nitro-5-benzofuranyl]-1-propanol IUPAC Name: 3-[2-(1,3-benzodioxol-5-yl)-7-methoxy-3-nitro-1-benzofuran-5-yl]propan-1-ol Traditional Name: 3-[2-(1,3-benzodioxol-5-yl)-7-methoxy-3-nitro-benzofuran-5-yl]propan-1-ol Formula: C19H17NO7 MolecularWeight: 371.34078

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1)CCCO)C(=C(O2)C3=CC4=C(C=C3)OCO4)[N+](=O)[O-]

Isomeric SMILES

COC1=C2C(=CC(=C1)CCCO)C(=C(O2)C3=CC4=C(C=C3)OCO4)[N+](=O)[O-]

InChI

InChI=1S/C19H17NO7/c1-24-16-8-11(3-2-6-21)7-13-17(20(22)23)18(27-19(13)16)12-4-5-14-15(9-12)26-10-25-14/h4-5,7-9,21H,2-3,6,10H2,1H3